Geometry & MOs

Info

ID:	60452
PubChem CID:	26686990
Reduced:	SO2N5H15C19 (1)
Stoich.:	AB2C5D15E19 (1)
Weight, g/mol:	405.078327
ΔH_f, kcal/mol:	51.79
Dipole, Da:	3.74
IP(EA), eV:	-8.81(-1.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-acetyl-1,3-thiazol-2-yl)-2-(2-methylphenyl)-1,3-dioxoisoindole-5-carboxamide

Drug info:

PubChemData

Smile

CC1=C(SC2=C1C(=O)N(C=N2)NC(=O)/C=C/C3=NC4=CC=CC=C4N=C3)C

DOS

IR

Vibrations