Geometry & MOs

Info

ID:	216031
PubChem CID:	85085608
Reduced:	OC7H8 (2)
Stoich.:	AB7C8 (2)
Weight, g/mol:	216.11503
ΔH_f, kcal/mol:	-63.77
Dipole, Da:	1.91
IP(EA), eV:	-9.26(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-phenylcyclohex-3-en-1-yl)acetic acid

Drug info:

PubChemData

Smile

CC(=O)OC1CCC=CC1C2=CC=CC=C2

DOS

IR

Vibrations