Geometry & MOs

Info

ID:	156318
PubChem CID:	56370066
Reduced:	ClO4N5H24C25 (1)
Stoich.:	AB4C5D24E25 (1)
Weight, g/mol:	424.097204
ΔH_f, kcal/mol:	-21.9
Dipole, Da:	9.63
IP(EA), eV:	-9.24(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-[(2-chlorophenyl)sulfonylamino]propanoylamino]-N-(pyridin-4-ylmethyl)propanamide

Drug info:

PubChemData

Smile

C1CN(CCN1C2=NC=C(C=C2)[N+](=O)[O-])C(=O)C(CC3=CC=CC=C3)NC(=O)C4=CC=C(C=C4)Cl

DOS

IR

Vibrations