Geometry & MOs

Info

ID:	315085
PubChem CID:	126624389
Reduced:	O4C11H18 (1)
Stoich.:	A4B11C18 (1)
Weight, g/mol:	182.167065
ΔH_f, kcal/mol:	-185.88
Dipole, Da:	4.7
IP(EA), eV:	-10.24(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-propan-2-ylcyclohex-3-en-1-yl)propan-2-ol

Drug info:

PubChemData

Smile

CCC(CC)(CC=C)OC(=O)CC(=O)O

DOS

IR

Vibrations