Geometry & MOs

Info

ID:	270110
PubChem CID:	103628628
Reduced:	ClNSO3C10H12 (1)
Stoich.:	ABCD3E10F12 (1)
Weight, g/mol:	344.90713
ΔH_f, kcal/mol:	-122.39
Dipole, Da:	5.62
IP(EA), eV:	-9.68(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-bromopyridin-2-yl)-5,6-dichloropyridine-3-carboxamide

Drug info:

PubChemData

Smile

C[C@@H](C(=O)O)NC(=O)CCC1=CC=C(S1)Cl

DOS

IR

Vibrations