Crystallography Open Database

Information card for entry 5000000

4519492 << 5000000 >> 5000001

Preview

Coordinates	5000000.cif
Original IUCr paper	HTML

Structure parameters

Formula	C6 H13 N O2
Calculated formula	C6 H13 N O2
Title of publication	L-Isoleucine, Redetermination at 120 K
Authors of publication	Görbitz, Carl Henrik; Dalhus, Bjørn
Journal of publication	Acta Crystallographica Section C
Year of publication	1996
Journal volume	52
Journal issue	6
Pages of publication	1464 - 1466
a	9.681 ± 0.005 Å
b	5.301 ± 0.003 Å
c	13.956 ± 0.006 Å
α	90°
β	96.16 ± 0.04°
γ	90°
Cell volume	712.07 Å³
Number of distinct elements	4
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Duplicate of	2004998
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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