Geometry & MOs

Info

ID:	309637
PubChem CID:	126551633
Reduced:	OC15H22 (1)
Stoich.:	AB15C22 (1)
Weight, g/mol:	392.2327
ΔH_f, kcal/mol:	-39.83
Dipole, Da:	1.22
IP(EA), eV:	-8.39(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[4-[(E)-pent-3-enyl]cyclohexyl]cyclohexen-1-yl]-4-(trifluoromethoxy)benzene

Drug info:

PubChemData

Smile

CC(C)CC1=CC(=CC=C1)COC=C(C)C

DOS

IR

Vibrations