Crystallography Open Database

Information card for entry 4339842

Preview

Coordinates	4339842.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H22 Ni3 O20
Calculated formula	C18 H6 Ni3 O20
Title of publication	[Ph(3)PCH(2)Ph](2)[Zn(3)(tp)(3)Cl(2)] and Ni(3)(tma)(2)(H(2)O)(8): two unusual claylike frameworks of metal-polycarboxylate coordination polymers (tp = terephthalate, tma = trimesate).
Authors of publication	Yang, Guo-Dong; Dai, Jing-Cao; Lian, Yun-Xia; Wu, Wen-Shi; Lin, Jian-Ming; Hu, Sheng-Min; Sheng, Tian-Lu; Fu, Zhi-Yong; Wu, Xin-Tao
Journal of publication	Inorganic chemistry
Year of publication	2007
Journal volume	46
Journal issue	19
Pages of publication	7910 - 7916
a	6.6643 ± 0.0008 Å
b	9.6222 ± 0.0011 Å
c	10.0889 ± 0.0011 Å
α	112.675 ± 0.002°
β	94.007 ± 0.001°
γ	106.411 ± 0.002°
Cell volume	560.82 ± 0.11 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0801
Residual factor for significantly intense reflections	0.0538
Weighted residual factors for significantly intense reflections	0.1364
Weighted residual factors for all reflections included in the refinement	0.1554
Goodness-of-fit parameter for all reflections included in the refinement	1.003
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179501 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/98.	4339842.cif
117570	2014-06-15	cif/ Adding structures of 4339841, 4339842, 4339843 via cif-deposit CGI script.	4339842.cif