Geometry & MOs

Info

ID:	379853
PubChem CID:	134465063
Reduced:	O2F3C25H27 (1)
Stoich.:	A2B3C25D27 (1)
Weight, g/mol:	388.176935
ΔH_f, kcal/mol:	-174.95
Dipole, Da:	5.19
IP(EA), eV:	-8.91(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-chloro-1,2-difluoro-3-methyl-7-(4-pentylcyclohexyl)biphenylene

Drug info:

PubChemData

Smile

CCCCCC1=CC2=C3C=CC(=C(C3=C2C(=C1F)F)F)C4CCC(CC4)C(=O)OC

DOS

IR

Vibrations