Geometry & MOs

Info

ID:	146591
PubChem CID:	53710629
Reduced:	ClOF3H4C7 (1)
Stoich.:	ABC3D4E7 (1)
Weight, g/mol:	366.124292
ΔH_f, kcal/mol:	-168.51
Dipole, Da:	2.47
IP(EA), eV:	-10.42(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3,5-difluoro-4-methylphenyl) 4-cyclohexyl-2,6-difluorobenzoate

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1C(O)Cl)F)F)F

DOS

IR

Vibrations