Geometry & MOs

Info

ID:	379339
PubChem CID:	134358650
Reduced:	OF2C30H40 (1)
Stoich.:	AB2C30D40 (1)
Weight, g/mol:	506.317179
ΔH_f, kcal/mol:	-132.86
Dipole, Da:	1.29
IP(EA), eV:	-8.84(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,3-difluoro-4-heptoxyphenyl)-2,3-difluoro-4-(4-hexylcyclohexyl)benzene

Drug info:

PubChemData

Smile

CCCCCCCCC1CCC(CC1)C2=CC=C(C=C2)C3=C(C(=C(C=C3)OCCC=C)F)F

DOS

IR

Vibrations