Geometry & MOs

Info

ID:	264294
PubChem CID:	103450925
Reduced:	O3C16H22 (1)
Stoich.:	A3B16C22 (1)
Weight, g/mol:	236.101271
ΔH_f, kcal/mol:	-127.91
Dipole, Da:	3.18
IP(EA), eV:	-8.94(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3,4-difluorophenyl)-(4-methylcyclohexen-1-yl)methanone

Drug info:

PubChemData

Smile

CCOC1=CC=CC(=C1)C(=O)C2(CCC(CC2)C)O

DOS

IR

Vibrations