Crystallography Open Database

Information card for entry 7211996

7211995 << 7211996 >> 7211997

Preview

Coordinates	7211996.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C4 H6 N3 Nd O7
Calculated formula	C4 H6 N3 Nd O7
Title of publication	A series of novel chiral lanthanide coordination polymers with channels constructed from 16Ln-based cage-like building units
Authors of publication	Yuan, Gang; Shao, Kui-Zhan; Wang, Xin-Long; Lan, Ya-Qian; Du, Dong-Ying; Su, Zhong-Min
Journal of publication	CrystEngComm
Year of publication	2010
Journal volume	12
Journal issue	4
Pages of publication	1147
a	8.805 ± 0.0009 Å
b	8.805 ± 0.0009 Å
c	9.883 ± 0.001 Å
α	90 ± 0.0012°
β	90 ± 0.001°
γ	120 ± 0.01°
Cell volume	663.56 ± 0.13 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	154
Hermann-Mauguin space group symbol	P 32 2 1
Hall space group symbol	P 32 2"
Residual factor for all reflections	0.0224
Residual factor for significantly intense reflections	0.022
Weighted residual factors for significantly intense reflections	0.0596
Weighted residual factors for all reflections included in the refinement	0.0598
Goodness-of-fit parameter for all reflections included in the refinement	1.049
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
180450 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/19.	7211996.cif
92527	2014-01-12	cif/ Adding structures of 7211993, 7211994, 7211995, 7211996, 7211997, 7211998, 7211999 via cif-deposit CGI script.	7211996.cif