Geometry & MOs

Info

ID:	56704
PubChem CID:	22388182
Reduced:	N4O7C14H16 (1)
Stoich.:	A4B7C14D16 (1)
Weight, g/mol:	483.113188
ΔH_f, kcal/mol:	-82.78
Dipole, Da:	6.66
IP(EA), eV:	-9.0(-1.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(benzenesulfonyl)-3-[[2-chloro-4-(dimethylamino)phenyl]methyl]-2-methylimidazo[4,5-b]pyridine-5-carboxamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=CCN(C=C1)N.C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])O

DOS

IR

Vibrations