Geometry & MOs

Info

ID:	360498
PubChem CID:	127301143
Reduced:	SN3O3C20H27 (1)
Stoich.:	AB3C3D20E27 (1)
Weight, g/mol:	367.156577
ΔH_f, kcal/mol:	-129.24
Dipole, Da:	5.81
IP(EA), eV:	-8.78(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)acetyl]-N-ethyl-N-methyl-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

CCC(=O)N1CCCC(C1)C(=O)N2CSCC2C(=O)NC3=CC=CC(=C3)C

DOS

IR

Vibrations