Crystallography Open Database

Information card for entry 5000189

Preview

Coordinates	5000189.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H15 N3 O6
Calculated formula	C12 H15 N3 O6
Title of publication	Solid-state photochemistry of nitro compounds: structure-reactivity correlations
Authors of publication	Padmanabhan, Kaillathe; Döpp, Dietrich; Venkatesan, Kailasam; Ramamurthy, Vaidyanathan
Journal of publication	Journal of the Chemical Society, Perkin Transactions 2
Year of publication	1986
Journal issue	6
Pages of publication	897 - 906
a	9.226 ± 0.001 Å
b	11.104 ± 0.001 Å
c	14.622 ± 0.002 Å
α	90°
β	107.79 ± 0.01°
γ	90°
Cell volume	1426.33 Å³
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/a 1
Hall space group symbol	-P 2yab
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

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