Crystallography Open Database

Information card for entry 4001522

Preview

Coordinates	4001522.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C4 H17 Ga2 N3 O10 P2
Calculated formula	C4 H13 Ga2 N3 O10 P2
Title of publication	Unequivocal Heteroatom Insertion into a 24-Ring Channel Gallophosphate and Its Photoluminescence
Authors of publication	Lin, Chia-Her; Yang, Ya-Ching; Chen, Chun-Yu; Wang, Sue-Lein
Journal of publication	Chemistry of Materials
Year of publication	2006
Journal volume	18
Journal issue	8
Pages of publication	2095
a	23.7807 ± 0.0015 Å
b	23.7807 ± 0.0015 Å
c	13.4664 ± 0.0012 Å
α	90°
β	90°
γ	120°
Cell volume	6595.3 ± 0.8 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	148
Hermann-Mauguin space group symbol	R -3 :H
Hall space group symbol	-R 3
Residual factor for all reflections	0.0335
Residual factor for significantly intense reflections	0.0272
Weighted residual factors for significantly intense reflections	0.0844
Weighted residual factors for all reflections included in the refinement	0.0874
Goodness-of-fit parameter for all reflections included in the refinement	1.015
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
178377 (current)	2016-03-21	cif/4/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/00.	4001522.cif
120073	2014-07-11	Adding DOIs to range 4/00 structures.	4001522.cif
47591	2012-03-26	../uploads/cif-deposit/cod/cif Adding structures of 4001522 via cif-deposit CGI script.	4001522.cif