Geometry & MOs

Info

ID:	205610
PubChem CID:	80126128
Reduced:	BrNSF2O3H6C12 (1)
Stoich.:	ABCD2E3F6G12 (1)
Weight, g/mol:	340.00228
ΔH_f, kcal/mol:	-156.8
Dipole, Da:	6.79
IP(EA), eV:	-9.82(-1.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-amino-4-methylphenyl)-4-bromo-2,6-difluorobenzamide

Drug info:

PubChemData

Smile

C1=CSC(=C1C(=O)O)NC(=O)C2=C(C=C(C=C2F)Br)F

DOS

IR

Vibrations