Geometry & MOs

Info

ID:	339268
PubChem CID:	127260647
Reduced:	OC15H22 (1)
Stoich.:	AB15C22 (1)
Weight, g/mol:	204.151415
ΔH_f, kcal/mol:	-50.5
Dipole, Da:	3.79
IP(EA), eV:	-9.5(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2Z)-2-[(2-methylcyclohex-3-en-1-yl)methylidene]cyclohexan-1-one

Drug info:

PubChemData

Smile

CC1CC=CC(C1/C=C/2\CCCCC2=O)C

DOS

IR

Vibrations