Geometry & MOs

Info

ID:	379340
PubChem CID:	134358688
Reduced:	OF4C31H42 (1)
Stoich.:	AB4C31D42 (1)
Weight, g/mol:	420.207628
ΔH_f, kcal/mol:	-257.07
Dipole, Da:	4.56
IP(EA), eV:	-9.12(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-butoxy-4-[2,3-difluoro-4-[4-[(E)-prop-1-enyl]cyclohexyl]phenyl]-2,3-difluorobenzene

Drug info:

PubChemData

Smile

CCCCCCCOC1=C(C(=C(C=C1)C2=C(C(=C(C=C2)C3CCC(CC3)CCCCCC)F)F)F)F

DOS

IR

Vibrations