Crystallography Open Database

Information card for entry 5000148

Preview

Coordinates	5000148.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C3 H6 N6 O6
Calculated formula	C3 H6 N6 O6
Title of publication	The crystal structure of cyclotrimethylenetrinitramine
Authors of publication	Choi, C. S.; Prince, E.
Journal of publication	Acta Crystallographica Section B
Year of publication	1972
Journal volume	28
Journal issue	9
Pages of publication	2857 - 2862
a	13.182 ± 0.002 Å
b	11.574 ± 0.002 Å
c	10.709 ± 0.002 Å
α	90°
β	90°
γ	90°
Cell volume	1633.86 Å³
Number of distinct elements	4
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

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