Geometry & MOs

Info

ID:	356151
PubChem CID:	127291187
Reduced:	O2S2N3C19H21 (1)
Stoich.:	A2B2C3D19E21 (1)
Weight, g/mol:	389.123169
ΔH_f, kcal/mol:	-25.85
Dipole, Da:	1.97
IP(EA), eV:	-8.9(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,2-dimethylpropanoyl)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=NC(=CS1)C2=CC(=CC=C2)NC(=O)C3CSCN3C(=O)C4CCC4

DOS

IR

Vibrations