Geometry & MOs

Info

ID:	276701
PubChem CID:	103824738
Reduced:	BrClFNO2H10C14 (1)
Stoich.:	ABCDE2F10G14 (1)
Weight, g/mol:	299.9665
ΔH_f, kcal/mol:	-83.37
Dipole, Da:	8.62
IP(EA), eV:	-8.98(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-bromo-3-chlorophenyl)-2-cyano-2-methylpropanamide

Drug info:

PubChemData

Smile

COC1=C(C(=CC=C1)F)C(=O)NC2=CC(=C(C=C2)Br)Cl

DOS

IR

Vibrations