Geometry & MOs

Info

ID:	352565
PubChem CID:	127283653
Reduced:	ON2C6H8 (3)
Stoich.:	AB2C6D8 (3)
Weight, g/mol:	389.177313
ΔH_f, kcal/mol:	-54.18
Dipole, Da:	4.28
IP(EA), eV:	-9.01(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3,3-dimethylbutanoyl)-N-[3-(2-oxopyrrolidin-1-yl)phenyl]-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=O)N2C(=N1)C=CN2)CC(=O)N3CCN(CC3)CC(=O)NC4CC4

DOS

IR

Vibrations