Geometry & MOs

Info

ID:	169557
PubChem CID:	75120115
Reduced:	SO4N5C22H23 (1)
Stoich.:	AB4C5D22E23 (1)
Weight, g/mol:	461.082761
ΔH_f, kcal/mol:	-59.67
Dipole, Da:	5.89
IP(EA), eV:	-7.97(-1.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[3-[3-(methanesulfonamido)anilino]-3-oxopropyl]-1,3-thiazol-2-yl]-6-oxo-3H-pyridine-3-carboxamide

Drug info:

PubChemData

Smile

C1COCCN1C2=CC=C(C=C2)NC(=O)CCC3=CSC(=N3)NC(=O)C4C=CC=NC4=O

DOS

IR

Vibrations