Geometry & MOs

Info

ID:	62156
PubChem CID:	26717794
Reduced:	ClSO3N4C23H25 (1)
Stoich.:	ABC3D4E23F25 (1)
Weight, g/mol:	472.13359
ΔH_f, kcal/mol:	-86.98
Dipole, Da:	4.3
IP(EA), eV:	-8.9(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-chloro-2-methylphenyl)-3-[[2-[(5S)-2-(diethylamino)-4-oxo-1,3-thiazol-5-yl]acetyl]amino]benzamide

Drug info:

PubChemData

Smile

CCN(CC)C1=NC(=O)[C@H](S1)CC(=O)NC2=CC=CC(=C2)C(=O)NC3=C(C=C(C=C3)Cl)C

DOS

IR

Vibrations