Geometry & MOs

Info

ID:	389921
PubChem CID:	134996017
Reduced:	FO2C6H9 (1)
Stoich.:	AB2C6D9 (1)
Weight, g/mol:	240.091708
ΔH_f, kcal/mol:	-142.07
Dipole, Da:	4.8
IP(EA), eV:	-10.93(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,2S,3S)-2-chloro-3-phenylmethoxycyclohexan-1-ol

Drug info:

PubChemData

Smile

CC(/C(=C\C(=O)O)/C)F

DOS

IR

Vibrations