Geometry & MOs

Info

ID:	270980
PubChem CID:	103639069
Reduced:	BrNOF2H10C14 (1)
Stoich.:	ABCD2E10F14 (1)
Weight, g/mol:	323.9665
ΔH_f, kcal/mol:	-87.13
Dipole, Da:	4.57
IP(EA), eV:	-9.46(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-bromo-2-methylphenyl)-6-chloropyridine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1Br)NC(=O)C2=C(C=CC(=C2)F)F

DOS

IR

Vibrations