name stringlengths 9 16 | description stringlengths 419 314k |
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TAKVAF_clean | FeC8H4O5 crystallizes in the tetragonal I4_122 space group. Fe(1) is bonded to two equivalent O(1), two equivalent O(2), and two equivalent O(3) atoms to form corner-sharing FeO6 octahedra. The corner-sharing octahedral tilt angles are 55°. Both Fe(1)-O(1) bond lengths are 1.97 Å. Both Fe(1)-O(2) bond lengths are 1.98 ... |
RIGPEE_clean | CuH14(C5N)4 crystallizes in the monoclinic P2_1/c space group. The structure consists of a CuH14(C5N)4 framework. Cu(1) is bonded in a trigonal planar geometry to one N(1), one N(2), and one N(3) atom. The Cu(1)-N(1) bond length is 1.98 Å. The Cu(1)-N(2) bond length is 1.98 Å. The Cu(1)-N(3) bond length is 2.02 Å. Ther... |
BUXNIT_clean | CoC17N4H13CoC26H18(NO)4(CH)11CH3CHOC4H4OCH2CO is Indium-derived structured and crystallizes in the orthorhombic P2_12_12_1 space group. The structure is zero-dimensional and consists of forty-four 02329_fluka molecules, four 2-methoxypropene molecules, four dimethyl ether molecules, four dimethyl ether molecules, four ... |
WOJJOV_SL | AlH5(C2O)5(CH)2 crystallizes in the tetragonal P4/nmm space group. The structure consists of sixteen 02329_fluka molecules inside a AlH5(C2O)5 framework. In the AlH5(C2O)5 framework, there are two inequivalent Al sites. In the first Al site, Al(1) is bonded to two equivalent O(3) and four equivalent O(1) atoms to form ... |
MATFIY_clean | Ag7H20(C6N5)5 crystallizes in the triclinic P-1 space group. There are seven inequivalent Ag sites. In the first Ag site, Ag(1) is bonded in a bent 120 degrees geometry to one N(19) and one N(7) atom. The Ag(1)-N(19) bond length is 2.22 Å. The Ag(1)-N(7) bond length is 2.19 Å. In the second Ag site, Ag(2) is bonded in ... |
ACOGAB_clean | CdC8H8(N2Br)2(C6N2H7O)4 is Indium-derived structured and crystallizes in the monoclinic C2/c space group. The structure is zero-dimensional and consists of sixteen C6N2H7O clusters and four CdC8H8(N2Br)2 clusters. In eight of the C6N2H7O clusters, there are six inequivalent C sites. In the first C site, C(3) is bonded ... |
OFUSEP_clean | Ag2C6PN3H12S crystallizes in the monoclinic P2_1 space group. There are four inequivalent Ag sites. In the first Ag site, Ag(1) is bonded in a distorted T-shaped geometry to one N(4), one S(1), and one S(2) atom. The Ag(1)-N(4) bond length is 2.32 Å. The Ag(1)-S(1) bond length is 2.71 Å. The Ag(1)-S(2) bond length is 2... |
INAMUG_clean | Co2C36N5H26O8(CH)8(CH2)3C2NH2 crystallizes in the triclinic P-1 space group. The structure consists of six 02329_fluka molecules, four isobutylene molecules, and two n-methyl methanimine molecules inside a Co2C36N5H26O8 framework. In the Co2C36N5H26O8 framework, there are three inequivalent Co sites. In the first Co si... |
HOZTOG_clean | WCu6C32H24S4(N6I)4 crystallizes in the cubic I-43d space group. W(1) is bonded in a 10-coordinate geometry to two equivalent Cu(2), four equivalent Cu(1), and four equivalent S(1) atoms. Both W(1)-Cu(2) bond lengths are 2.69 Å. All W(1)-Cu(1) bond lengths are 2.73 Å. All W(1)-S(1) bond lengths are 2.26 Å. There are two... |
WAQTEQ_clean | Zn2C12H6(NO2)3 crystallizes in the trigonal R-3 space group. There are two inequivalent Zn sites. In the first Zn site, Zn(1) is bonded in a distorted see-saw-like geometry to one N(3), one O(2), one O(4), and one O(6) atom. The Zn(1)-N(3) bond length is 2.07 Å. The Zn(1)-O(2) bond length is 2.07 Å. The Zn(1)-O(4) bond... |
ZERNUH_clean | Dy2C33N3H17O13(CH)6 crystallizes in the triclinic P-1 space group. The structure consists of twelve 02329_fluka molecules inside a Dy2C33N3H17O13 framework. In the Dy2C33N3H17O13 framework, there are two inequivalent Dy sites. In the first Dy site, Dy(1) is bonded to one O(1), one O(11), one O(12), one O(5), one O(8), ... |
CANROA_clean | Co3SiH22(C20O7)2Si(C3H2)4(C2HO)2 crystallizes in the triclinic P-1 space group. The structure consists of two methacrylic acid molecules and two tetrakis(prop-1-en-2-yl)silane molecules inside a Co3SiH22(C20O7)2 framework. In the Co3SiH22(C20O7)2 framework, there are four inequivalent Co sites. In the first Co site, Co... |
KUCDES_clean | LiBH20(C2N)8 crystallizes in the cubic P432 space group. Li(1) is bonded in a tetrahedral geometry to one N(2), one N(4), one N(6), and one N(8) atom. The Li(1)-N(2) bond length is 2.03 Å. The Li(1)-N(4) bond length is 2.04 Å. The Li(1)-N(6) bond length is 2.00 Å. The Li(1)-N(8) bond length is 2.01 Å. B(1) is bonded in... |
OFERUN_clean | ZnH10(C2N)4 crystallizes in the cubic I-43m space group. Zn(1) is bonded in a tetrahedral geometry to four equivalent N(1) atoms. All Zn(1)-N(1) bond lengths are 1.98 Å. There are three inequivalent C sites. In the first C site, C(1) is bonded in a distorted bent 120 degrees geometry to one N(1) and one H(1) atom. The ... |
TIRHIL_clean | CrAg(CO2)6 crystallizes in the cubic P2_13 space group. Cr(1) is bonded in an octahedral geometry to three equivalent O(1) and three equivalent O(2) atoms. All Cr(1)-O(1) bond lengths are 1.94 Å. All Cr(1)-O(2) bond lengths are 1.95 Å. Ag(1) is bonded in a distorted pentagonal pyramidal geometry to three equivalent O(3... |
KALGEL_clean | Ni2C22N4H16O9(C4H3)4(CH)2 crystallizes in the orthorhombic Fdd2 space group. The structure consists of sixteen 02329_fluka molecules and thirty-two isobutylene molecules inside a Ni2C22N4H16O9 framework. In the Ni2C22N4H16O9 framework, Ni(1) is bonded in a 6-coordinate geometry to one N(1), one N(2), one O(1), one O(2)... |
PUWYAI_clean | Na5Co6C17H2O33(CH2)7 crystallizes in the triclinic P-1 space group. The structure consists of fourteen 02329_fluka molecules inside a Na5Co6C17H2O33 framework. In the Na5Co6C17H2O33 framework, there are six inequivalent Na sites. In the first Na site, Na(1) is bonded in an L-shaped geometry to one O(29) and one O(30) a... |
NEGZUW_clean | V5Zn3C6N9H6O10 crystallizes in the orthorhombic Pbcn space group. There are six inequivalent V sites. In the first V site, V(1) is bonded to one O(10), one O(2), one O(5), one O(7), and one O(9) atom to form distorted VO5 square pyramids that share a cornercorner with one V(2)O5 square pyramid, a cornercorner with on... |
ROPVIB_clean | AgH4(CN)4 crystallizes in the monoclinic P2_1/c space group. There are six inequivalent Ag sites. In the first Ag site, Ag(1) is bonded in a tetrahedral geometry to one N(1), one N(23), one N(4), and one N(7) atom. The Ag(1)-N(1) bond length is 2.33 Å. The Ag(1)-N(23) bond length is 2.54 Å. The Ag(1)-N(4) bond length i... |
HICVOG_clean | Zn2C15N5H7O6(HC2N)2 crystallizes in the tetragonal P4_12_12 space group. The structure consists of eight n-methyl methanimine molecules inside a Zn2C15N5H7O6 framework. In the Zn2C15N5H7O6 framework, Zn(1) is bonded in a 5-coordinate geometry to one N(1), one N(3), one O(1), one O(2), and one O(3) atom. The Zn(1)-N(1) ... |
SABWEA_clean | Pr2CuC32H12(NO6)4 crystallizes in the triclinic P-1 space group. Pr(1) is bonded in a 6-coordinate geometry to one O(1), one O(10), one O(2), one O(3), one O(8), and one O(9) atom. The Pr(1)-O(1) bond length is 2.41 Å. The Pr(1)-O(10) bond length is 2.51 Å. The Pr(1)-O(2) bond length is 2.39 Å. The Pr(1)-O(3) bond leng... |
ODERIZ_clean | PdC6H4(N2O)2(CF)2 crystallizes in the cubic Pn-3m space group. The structure consists of twenty-four fluoromethane molecules inside a PdC6H4(N2O)2 framework. In the PdC6H4(N2O)2 framework, Pd(1) is bonded in a square co-planar geometry to four equivalent N(1) atoms. All Pd(1)-N(1) bond lengths are 1.95 Å. There are two... |
KAVKIC_clean | DyC5H(NO2)2 crystallizes in the tetragonal I4_1/a space group. There are two inequivalent Dy sites. In the first Dy site, Dy(1) is bonded in a 6-coordinate geometry to one N(2), one N(3), one O(2), one O(3), one O(4), and one O(8) atom. The Dy(1)-N(2) bond length is 2.55 Å. The Dy(1)-N(3) bond length is 2.38 Å. The Dy(... |
WOQTUT_clean | FeC5H5O4 crystallizes in the trigonal R-3 space group. Fe(1) is bonded to one H(2), one O(1), two equivalent O(2), and two equivalent O(3) atoms to form distorted edge-sharing FeHO5 octahedra. The Fe(1)-H(2) bond length is 1.57 Å. The Fe(1)-O(1) bond length is 2.08 Å. There is one shorter (2.07 Å) and one longer (2.33 ... |
YOYPOT_clean | Co2C45H21(N2O)6(CH)18 crystallizes in the trigonal P-31c space group. The structure consists of thirty-six 02329_fluka molecules inside a Co2C45H21(N2O)6 framework. In the Co2C45H21(N2O)6 framework, Co(1) is bonded in an octahedral geometry to three equivalent N(2) and three equivalent O(1) atoms. All Co(1)-N(2) bond l... |
GIXGOK_clean | CdC8H4(NO)4(CH)2 crystallizes in the cubic Im-3m space group. The structure consists of ninety-six 02329_fluka molecules inside a CdC8H4(NO)4 framework. In the CdC8H4(NO)4 framework, Cd(1) is bonded in a 8-coordinate geometry to two equivalent N(1), two equivalent N(2), two equivalent O(1), and two equivalent O(2) atom... |
NUYWOU_clean | CdC22N5H16O4(CH)3 is Indium-derived structured and crystallizes in the tetragonal P4_12_12 space group. The structure is zero-dimensional and consists of twelve 02329_fluka molecules and four CdC22N5H16O4 clusters. In each CdC22N5H16O4 cluster, Cd(1) is bonded in a pentagonal bipyramidal geometry to one N(3), two equiv... |
IFEHUY_clean | MnC4HSO2 crystallizes in the trigonal R-3c space group. There are two inequivalent Mn sites. In the first Mn site, Mn(1) is bonded in a distorted octahedral geometry to two equivalent S(1), two equivalent O(1), and two equivalent O(2) atoms. Both Mn(1)-S(1) bond lengths are 2.49 Å. Both Mn(1)-O(1) bond lengths are 2.28... |
CAVTAW_clean | LaC10P4(NO6)2 crystallizes in the monoclinic P2_1 space group. La(1) is bonded to one O(11), one O(12), one O(2), one O(5), one O(6), and one O(8) atom to form distorted LaO6 pentagonal pyramids that share a cornercorner with one P(1)CO3 tetrahedra, a cornercorner with one P(3)CO3 tetrahedra, corners with two equival... |
TIXMET_clean | Zn5P6(HO5)4 crystallizes in the monoclinic C2/c space group. There are three inequivalent Zn sites. In the first Zn site, Zn(1) is bonded to one O(2), one O(4), one O(5), and one O(9) atom to form ZnO4 tetrahedra that share a cornercorner with one P(2)HO3 tetrahedra, a cornercorner with one P(3)HO3 tetrahedra, and co... |
UJAQAY_clean | Mn3C32H14(NO8)2(C3H2O2)2 crystallizes in the monoclinic C2/c space group. The structure consists of eight dimethoxymethane molecules inside a Mn3C32H14(NO8)2 framework. In the Mn3C32H14(NO8)2 framework, there are two inequivalent Mn sites. In the first Mn site, Mn(1) is bonded in a 6-coordinate geometry to one N(1), on... |
COTVUE_clean | Dy2C28H13O13 crystallizes in the monoclinic P2_1/c space group. There are two inequivalent Dy sites. In the first Dy site, Dy(1) is bonded in a 6-coordinate geometry to one O(1), one O(10), one O(3), one O(4), one O(6), and one O(9) atom. The Dy(1)-O(1) bond length is 2.34 Å. The Dy(1)-O(10) bond length is 2.36 Å. The ... |
LURLOB_clean | CrC8H4O5 crystallizes in the orthorhombic Imma space group. Cr(1) is bonded to two equivalent O(2) and four equivalent O(1) atoms to form distorted corner-sharing CrO6 octahedra. The corner-sharing octahedral tilt angles are 23°. Both Cr(1)-O(2) bond lengths are 1.75 Å. All Cr(1)-O(1) bond lengths are 2.04 Å. There are... |
DAMDUT_clean | ZnC4H4(NI)2(ZnC16N5H10I2)2 is Indium-like structured and crystallizes in the orthorhombic Pbca space group. The structure is zero-dimensional and consists of sixteen ZnC16N5H10I2 clusters and eight ZnC4H4(NI)2 clusters. In eight of the ZnC16N5H10I2 clusters, Zn(2) is bonded in a tetrahedral geometry to one N(3), one N(... |
YANBAR02_clean | Co(HCOO)2 crystallizes in the monoclinic P2_1/c space group. There are four inequivalent Co sites. In the first Co site, Co(1) is bonded to one O(10), one O(11), one O(2), one O(6), one O(7), and one O(9) atom to form edge-sharing CoO6 octahedra. The Co(1)-O(10) bond length is 2.06 Å. The Co(1)-O(11) bond length is 2.1... |
WARFAY05_clean | ZnC16NH12O4 is alpha Po structured and crystallizes in the tetragonal I4/mcm space group. The structure is zero-dimensional and consists of four ZnC16NH12O4 clusters. Zn(1) is bonded in a distorted square pyramidal geometry to one N(1) and four equivalent O(1) atoms. The Zn(1)-N(1) bond length is 2.05 Å. All Zn(1)-O(1)... |
YOCDUR_clean | ZnC11H5O4 crystallizes in the tetragonal I-4 space group. There are four inequivalent Zn sites. In the first Zn site, Zn(1) is bonded in a tetrahedral geometry to one O(1), one O(15), one O(7), and one O(9) atom. The Zn(1)-O(1) bond length is 1.95 Å. The Zn(1)-O(15) bond length is 2.00 Å. The Zn(1)-O(7) bond length is ... |
DIRPIF_clean | ZnC33NH18O6 crystallizes in the triclinic P-1 space group. The structure consists of a ZnC33NH18O6 framework. There are two inequivalent Zn sites. In the first Zn site, Zn(1) is bonded in a 4-coordinate geometry to one O(1), one O(5), one O(6), and one O(8) atom. The Zn(1)-O(1) bond length is 2.03 Å. The Zn(1)-O(5) bon... |
WIPZEC_clean | CdC26H16(NO3)2(C3H2)2 is Indium-derived structured and crystallizes in the orthorhombic Pbcn space group. The structure is zero-dimensional and consists of eight 2,3-dimethyl-1,3-butadiene molecules and four CdC26H16(NO3)2 clusters. In each CdC26H16(NO3)2 cluster, Cd(1) is bonded to one N(1), one N(2), one O(2), one O(... |
XAJSEJ_clean | InC21NH8O8CH crystallizes in the orthorhombic P2_12_12_1 space group. The structure consists of four 02329_fluka molecules inside a InC21NH8O8 framework. In the InC21NH8O8 framework, In(1) is bonded in a distorted hexagonal bipyramidal geometry to one O(1), one O(2), one O(3), one O(4), one O(5), one O(6), one O(7), an... |
CAXWAB_clean | FeC4HO3 crystallizes in the trigonal R-3 space group. Fe(1) is bonded to one O(2), two equivalent O(1), and two equivalent O(3) atoms to form distorted edge-sharing FeO5 square pyramids. The Fe(1)-O(2) bond length is 2.21 Å. There is one shorter (1.98 Å) and one longer (2.03 Å) Fe(1)-O(1) bond length. There is one shor... |
HAWWAF_clean | DyC12H4(SO4)2 crystallizes in the monoclinic P2_1/c space group. Dy(1) is bonded in a 8-coordinate geometry to one O(1), one O(2), one O(3), one O(4), one O(5), one O(6), one O(7), and one O(8) atom. The Dy(1)-O(1) bond length is 2.35 Å. The Dy(1)-O(2) bond length is 2.27 Å. The Dy(1)-O(3) bond length is 2.34 Å. The Dy... |
UPIBOM_clean | TbH3(C3O2)3 crystallizes in the tetragonal P4_3 space group. Tb(1) is bonded in a pentagonal pyramidal geometry to one O(1), one O(2), one O(3), one O(4), one O(5), and one O(6) atom. The Tb(1)-O(1) bond length is 2.31 Å. The Tb(1)-O(2) bond length is 2.32 Å. The Tb(1)-O(3) bond length is 2.33 Å. The Tb(1)-O(4) bond le... |
FIYDOH_clean | V2CoC6N3H6O4(C3H2)3 crystallizes in the monoclinic C2/c space group. The structure consists of twelve 2,3-dimethyl-1,3-butadiene molecules inside a V2CoC6N3H6O4 framework. In the V2CoC6N3H6O4 framework, there are two inequivalent V sites. In the first V site, V(1) is bonded in a trigonal non-coplanar geometry to one O(... |
WUJPIC_clean | NaCo2C36H6(NO6)2(CH6)2 crystallizes in the tetragonal P4_2/m space group. The structure consists of four methane;molecular hydrogen molecules inside a NaCo2C36H6(NO6)2 framework. In the NaCo2C36H6(NO6)2 framework, Na(1) is bonded in a distorted octahedral geometry to two equivalent O(3) and four equivalent O(1) atoms. ... |
URUVUA_clean | PdCu2C14N2H6(O2Cl)4 crystallizes in the trigonal R-3m space group. Pd(1) is bonded in an octahedral geometry to two equivalent N(1) and four equivalent Cl(1) atoms. Both Pd(1)-N(1) bond lengths are 2.02 Å. All Pd(1)-Cl(1) bond lengths are 2.30 Å. Cu(1) is bonded in a distorted square co-planar geometry to two equivalen... |
ODIXEG_clean | Si(C3H2)4(ZnC8H4O4)2 is Indium-derived structured and crystallizes in the tetragonal P4_2/mmc space group. The structure is zero-dimensional and consists of two tetrakis(prop-1-en-2-yl)silane molecules and two ZnC8H4O4 clusters. In each ZnC8H4O4 cluster, Zn(1) is bonded in a distorted square co-planar geometry to four ... |
GULWIU_clean | Cd4C24N20H16Cl3 is Indium-like structured and crystallizes in the orthorhombic Pbcn space group. The structure is zero-dimensional and consists of four Cd4C24N20H16Cl3 clusters. There are four inequivalent Cd sites. In the first Cd site, Cd(1) is bonded in a distorted T-shaped geometry to one N(1), one N(14), and one N... |
EXENAX_clean | AgC4N3H4I crystallizes in the monoclinic P2_1/c space group. There are two inequivalent Ag sites. In the first Ag site, Ag(1) is bonded in a 3-coordinate geometry to one N(1), one N(4), and one I(2) atom. The Ag(1)-N(1) bond length is 2.26 Å. The Ag(1)-N(4) bond length is 2.26 Å. The Ag(1)-I(2) bond length is 3.09 Å. I... |
CUNRAG_clean | GaCP2H2O10 crystallizes in the monoclinic P2_1/c space group. There are two inequivalent Ga sites. In the first Ga site, Ga(1) is bonded to one O(1), one O(2), one O(3), one O(4), one O(5), and one O(6) atom to form GaO6 octahedra that share a cornercorner with one P(2)O4 tetrahedra and corners with three equivalent P... |
KIPKAX_clean | Yb4C57H18(O4F3)6 crystallizes in the triclinic P-1 space group. There are four inequivalent Yb sites. In the first Yb site, Yb(1) is bonded in a 5-coordinate geometry to one O(1), one O(13), one O(2), one O(23), and one O(9) atom. The Yb(1)-O(1) bond length is 2.34 Å. The Yb(1)-O(13) bond length is 2.24 Å. The Yb(1)-O(... |
CUCSAU_clean | Li5H37(C7N3)3(CH)21 is Indium-derived structured and crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of thirty 02329_fluka molecules, four propylene molecules, and two Li5H37(C7N3)3 clusters. In each Li5H37(C7N3)3 cluster, there are five inequivalent Li sites. In the first ... |
TIRQOB_clean | Zn4C36H12O13(CH)12 crystallizes in the cubic I-43d space group. The structure consists of one hundred and ninety-two 02329_fluka molecules inside a Zn4C36H12O13 framework. In the Zn4C36H12O13 framework, there are two inequivalent Zn sites. In the first Zn site, Zn(1) is bonded to one O(1), one O(2), one O(3), and one O... |
REBRUM_clean | Mg2Ga(PO4)4 crystallizes in the cubic I-43m space group. Mg(1) is bonded to four equivalent O(1) atoms to form MgO4 tetrahedra that share corners with four equivalent P(1)O4 tetrahedra. All Mg(1)-O(1) bond lengths are 1.87 Å. Ga(1) is bonded to four equivalent O(3) atoms to form GaO4 tetrahedra that share corners with ... |
BIRSEC_clean | Co7C45H29(NO6)4(CH)3 crystallizes in the orthorhombic Pba2 space group. The structure consists of six 02329_fluka molecules inside a Co7C45H29(NO6)4 framework. In the Co7C45H29(NO6)4 framework, there are four inequivalent Co sites. In the first Co site, Co(1) is bonded to one N(2), one O(10), one O(11), one O(4), and o... |
QUNWAZ_clean | Zn3C20H12(N2O7)2(ZnC10NH6O4)2(C19H9)4(CH)28(C3H2)4(C9H4)8 is Indium-derived structured and crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of twenty-eight 02329_fluka molecules; two 2,3-dimethyl-1,3-butadiene molecules; two C19H9 clusters; two C9H4 clusters; one Zn3C20H12(N... |
GULCAS_clean | Fe3P4H4(O6F)2 crystallizes in the monoclinic C2/c space group. There are two inequivalent Fe sites. In the first Fe site, Fe(1) is bonded to one O(1), one O(2), one O(3), one O(4), and one F(1) atom to form FeO4F square pyramids that share a cornercorner with one Fe(2)O4F2 octahedra, corners with two equivalent P(1)HO... |
NIKYOW_clean | Fe(HCOO)2 crystallizes in the monoclinic P2_1/c space group. There are four inequivalent Fe sites. In the first Fe site, Fe(1) is bonded to one O(1), one O(11), one O(3), one O(5), one O(7), and one O(9) atom to form a mixture of edge and corner-sharing FeO6 octahedra. The corner-sharing octahedral tilt angles range fr... |
HEDCIE_clean | Cu(OOCC6H4COO)CuC10NH6O4(CH)8C3H2(C2O)2 is Indium-derived structured and crystallizes in the monoclinic C2/c space group. The structure is zero-dimensional and consists of sixty-four 02329_fluka molecules; four 2,3-dimethyl-1,3-butadiene molecules; sixteen dimethyl ether molecules; four Cu(OOCC6H4COO) clusters; and fou... |
QOFBIY_clean | AgH12(C3N)6 is Indium-like structured and crystallizes in the monoclinic C2/c space group. The structure is zero-dimensional and consists of eight AgH12(C3N)6 clusters. There are two inequivalent Ag sites. In the first Ag site, Ag(1) is bonded in a trigonal planar geometry to one N(1), one N(3), and one N(9) atom. The ... |
GUVBOQ_clean | Zn9H84(C81O37)2 crystallizes in the cubic P4_132 space group. There are two inequivalent Zn sites. In the first Zn site, Zn(1) is bonded to one O(1), one O(13), one O(4), and one O(6) atom to form corner-sharing ZnO4 tetrahedra. The Zn(1)-O(1) bond length is 1.96 Å. The Zn(1)-O(13) bond length is 2.02 Å. The Zn(1)-O(4)... |
RIYBEI_clean | (ZnC4H4(NI)2)2ZnC16N5H10I2(C4NH2)3 is Indium-derived structured and crystallizes in the orthorhombic Pbca space group. The structure is zero-dimensional and consists of eight C4NH2 clusters, eight ZnC16N5H10I2 clusters, and sixteen ZnC4H4(NI)2 clusters. In each C4NH2 cluster, there are twelve inequivalent C sites. In t... |
EXEQAA_clean | ScC8H4O5 crystallizes in the orthorhombic I2_12_12_1 space group. There are three inequivalent Sc sites. In the first Sc site, Sc(1) is bonded to one O(10), one O(13), one O(15), one O(2), one O(7), and one O(8) atom to form corner-sharing ScO6 octahedra. The corner-sharing octahedral tilt angles are 54°. The Sc(1)-O(1... |
VICYUD_clean | Zn2C26N4H12O9(CH)2 crystallizes in the monoclinic P2_1/c space group. The structure consists of eight 02329_fluka molecules inside a Zn2C26N4H12O9 framework. In the Zn2C26N4H12O9 framework, there are two inequivalent Zn sites. In the first Zn site, Zn(1) is bonded in a square pyramidal geometry to one N(1), one N(2), o... |
LEZWUK_clean | Lu3W12C21N3H9O43 crystallizes in the trigonal R3c space group. Lu(1) is bonded in a 3-coordinate geometry to one O(2), one O(6), and one O(7) atom. The Lu(1)-O(2) bond length is 2.37 Å. The Lu(1)-O(6) bond length is 2.27 Å. The Lu(1)-O(7) bond length is 2.25 Å. There are four inequivalent W sites. In the first W site, ... |
YOYVOZ_clean | FeAu2H4(C4N3)2(C4NH2)2 crystallizes in the trigonal R-3m space group. The structure consists of six C4NH2 clusters inside a FeAu2H4(C4N3)2 framework. In each C4NH2 cluster, there are three inequivalent C sites. In the first C site, C(3) is bonded in a distorted single-bond geometry to one C(4) and one H(2) atom. The C(... |
WUNVOR_clean | CdH32(C11N3)4(CH)4 is Indium-derived structured and crystallizes in the tetragonal P4_32_12 space group. The structure is zero-dimensional and consists of sixteen 02329_fluka molecules and four CdH32(C11N3)4 clusters. In each CdH32(C11N3)4 cluster, Cd(1) is bonded in a distorted octahedral geometry to two equivalent N(... |
MUTNAQ_clean | AgC14N4H12O is Indium-like structured and crystallizes in the orthorhombic Pnnm space group. The structure is zero-dimensional and consists of two AgC14N4H12O clusters. Ag(1) is bonded in a 4-coordinate geometry to two equivalent N(1) and two equivalent N(2) atoms. Both Ag(1)-N(1) bond lengths are 2.47 Å. Both Ag(1)-N(... |
WILGII_clean | AgH6(C2N)4 crystallizes in the monoclinic P2_1 space group. There are three inequivalent Ag sites. In the first Ag site, Ag(1) is bonded in a distorted T-shaped geometry to one N(1), one N(3), and one N(5) atom. The Ag(1)-N(1) bond length is 2.24 Å. The Ag(1)-N(3) bond length is 2.24 Å. The Ag(1)-N(5) bond length is 2.... |
HIDBIH_clean | Cd2C25H15(N3O)4(CH)3 crystallizes in the monoclinic C2/c space group. The structure consists of twelve 02329_fluka molecules inside a Cd2C25H15(N3O)4 framework. In the Cd2C25H15(N3O)4 framework, Cd(1) is bonded in a distorted trigonal bipyramidal geometry to one N(1), one N(4), one N(6), one O(1), and one O(2) atom. Th... |
EKOPIE_clean | Sr2CdC14H6(NO7)2(CH)2 crystallizes in the tetragonal P4_12_12 space group. The structure consists of eight 02329_fluka molecules inside a Sr2CdC14H6(NO7)2 framework. In the Sr2CdC14H6(NO7)2 framework, Sr(1) is bonded in a 7-coordinate geometry to one O(2), one O(3), one O(4), one O(5), one O(7), and two equivalent O(6)... |
XEHSAF_clean | Mg(HCOO)2 crystallizes in the monoclinic P2_1/c space group. There are four inequivalent Mg sites. In the first Mg site, Mg(1) is bonded to one O(1), one O(11), one O(3), one O(5), one O(7), and one O(9) atom to form a mixture of edge and corner-sharing MgO6 octahedra. The corner-sharing octahedral tilt angles range fr... |
RAWZIA_clean | AlC10H2O9 crystallizes in the monoclinic C2/c space group. Al(1) is bonded to two equivalent O(1), two equivalent O(2), and two equivalent O(5) atoms to form corner-sharing AlO6 octahedra. The corner-sharing octahedral tilt angles are 54°. Both Al(1)-O(1) bond lengths are 1.89 Å. Both Al(1)-O(2) bond lengths are 1.91 Å... |
JELPAS_clean | Fe3As4H3(CO7)3 crystallizes in the trigonal P-3c1 space group. Fe(1) is bonded to one O(1), one O(2), one O(3), one O(5), one O(6), and one O(7) atom to form FeO6 octahedra that share corners with three equivalent As(1)O4 tetrahedra. The Fe(1)-O(1) bond length is 1.93 Å. The Fe(1)-O(2) bond length is 1.99 Å. The Fe(1)-... |
PASKAX_clean | CdC14H10(NO)4(CH)4(C4H3O)2 is Indium-derived structured and crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of eight 02329_fluka molecules; two 2,3-bis(methoxymethyl)buta-1,3-diene molecules; and one CdC14H10(NO)4 cluster. In the CdC14H10(NO)4 cluster, Cd(1) is bonded to on... |
HABQUY_clean | CuC13H5O4C7H3 is Indium-derived structured and crystallizes in the cubic Fm-3m space group. The structure is zero-dimensional and consists of thirty-two 1,3,5-tris(3-methylbut-3-en-1-ynyl)benzene molecules and four CuC13H5O4 clusters. In each CuC13H5O4 cluster, there are two inequivalent Cu sites. In the first Cu site,... |
USEVOF_clean | Cu3C14H6I(NO4)2 crystallizes in the tetragonal I4/mmm space group. There are two inequivalent Cu sites. In the first Cu site, Cu(1) is bonded in a distorted square co-planar geometry to two equivalent O(1) and two equivalent O(2) atoms. Both Cu(1)-O(1) bond lengths are 1.96 Å. Both Cu(1)-O(2) bond lengths are 1.97 Å. I... |
WOLREV_clean | Mn2C29N16H16 crystallizes in the cubic Ia-3d space group. There are two inequivalent Mn sites. In the first Mn site, Mn(1) is bonded in an octahedral geometry to six equivalent N(2) atoms. All Mn(1)-N(2) bond lengths are 2.33 Å. In the second Mn site, Mn(2) is bonded in a distorted T-shaped geometry to three equivalent... |
WUZQOZ_clean | CuH8(CN2)8 crystallizes in the triclinic P-1 space group. Cu(1) is bonded in a rectangular see-saw-like geometry to one N(3), one N(4), one N(6), and one N(7) atom. The Cu(1)-N(3) bond length is 2.01 Å. The Cu(1)-N(4) bond length is 2.02 Å. The Cu(1)-N(6) bond length is 2.05 Å. The Cu(1)-N(7) bond length is 2.01 Å. The... |
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