Geometry & MOs

Info

ID:	379337
PubChem CID:	134358621
Reduced:	OF2C27H34 (1)
Stoich.:	AB2C27D34 (1)
Weight, g/mol:	440.289072
ΔH_f, kcal/mol:	-121.86
Dipole, Da:	4.03
IP(EA), eV:	-8.85(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-but-3-enoxy-2,3-difluoro-4-[4-(4-heptylcyclohexyl)phenyl]benzene

Drug info:

PubChemData

Smile

CCCCCC1CCC(CC1)C2=CC=C(C=C2)C3=C(C(=C(C=C3)OC/C=C/C)F)F

DOS

IR

Vibrations