Crystallography Open Database

Information card for entry 4343325

Preview

Coordinates	4343325.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C49 H97 Mo6 N3 O20
Calculated formula	C49 H97 Mo6 N3 O20
Title of publication	Synthesis and Crystallization Behavior of Surfactants with Hexamolybdate as the Polar Headgroup.
Authors of publication	Zhu, Li; Chen, Kun; Hao, Jian; Wei, Zheyu; Zhang, Haocheng; Yin, Panchao; Wei, Yongge
Journal of publication	Inorganic chemistry
Year of publication	2015
Journal volume	54
Journal issue	13
Pages of publication	6075 - 6077
a	12.5138 ± 0.0015 Å
b	19.151 ± 0.002 Å
c	27.068 ± 0.003 Å
α	90°
β	100.25 ± 0.0017°
γ	90°
Cell volume	6383.4 ± 1.2 Å³
Cell temperature	566 ± 2 K
Ambient diffraction temperature	566 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0682
Residual factor for significantly intense reflections	0.0517
Weighted residual factors for significantly intense reflections	0.1013
Weighted residual factors for all reflections included in the refinement	0.111
Goodness-of-fit parameter for all reflections included in the refinement	1.109
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
141327 (current)	2015-07-08	cif/ Updating files of 4343325, 4343326, 4343327 Original log message: Adding full bibliography for 4343325--4343327.cif.	4343325.cif
139161	2015-06-14	cif/ Adding structures of 4343325 via cif-deposit CGI script.	4343325.cif