Common molecules sample 50602

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Empirical formula:	C₈H₁₇N₁O₁
a:	7.442 Å
b:	9.400 Å
c:	14.644 Å
α (alpha):	90.00 °
β (beta):	90.00 °
γ (gamma):	90.00 °
Volume:	1024.42 Å³
Space group:	P2₁2₁2₁
Calculated density:	0.929 g/cm³
Color:	colorless
Z:	4
Formula weight:	143.229 g/mole
R(F):	0.0300
R_w(F):	0.0300
Common name:	Hemlock
CSD refcode:	RERKEE
Short description:	Hemlock is a poisonous herb of the parsley family.
Keyword:	alkaloid
Keyword:	herb
Keyword:	toxin
Layman's explanation:	Hemlock is an herb with a purple-spotted stem and leaves resembling parsley. The leaves are nauseating to eat, and ingestion may be fatal. The chemical poisons in hemlock are alkaloids like coniine and they affect the nervous system. Hemlock is the poison that Socrates was offered to cause his death.
IUPAC name:	(2S,5S)-2-Propyl-5-hydroxypyridine
Citation of a publication:	Reference: Liebigs Ann. Chem. (1997) p1267 Authors: M. Dockner, N.A. Sasacki, C. Riche, P. Potier
Lab name:	Common molecules
Sample provider:	Obtained courtesy of the Cambridge Structural Database
Status:	Complete, visible to public

Repository Files:
50602.cif	50602.crt	50602.gif	50602.GIF	50602.ort
50602.pdb	50602.sdt