Geometry & MOs

Info

ID:	21250
PubChem CID:	587774
Reduced:	F2C25H38 (1)
Stoich.:	A2B25C38 (1)
Weight, g/mol:	376.294158
ΔH_f, kcal/mol:	-144.72
Dipole, Da:	3.6
IP(EA), eV:	-9.51(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,2-difluoro-4-[4-[2-(4-pentylcyclohexyl)ethyl]cyclohexyl]benzene

Drug info:

PubChemData

Smile

CCCCCC1CCC(CC1)CCC2CCC(CC2)C3=CC(=C(C=C3)F)F

DOS

IR

Vibrations