Geometry & MOs

Info

ID:	198280
PubChem CID:	79079800
Reduced:	OF2N2C13H14 (1)
Stoich.:	AB2C2D13E14 (1)
Weight, g/mol:	210.060469
ΔH_f, kcal/mol:	-120.61
Dipole, Da:	4.68
IP(EA), eV:	-8.56(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyano-N-(2,2-difluoroethyl)benzamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=CN2)CCC(=O)NCC(F)F

DOS

IR

Vibrations