Geometry & MOs

Info

ID:	360121
PubChem CID:	127300506
Reduced:	SO2N4C19H22 (1)
Stoich.:	AB2C4D19E22 (1)
Weight, g/mol:	385.157246
ΔH_f, kcal/mol:	-32.79
Dipole, Da:	3.8
IP(EA), eV:	-8.84(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-oxo-1-phenylpyrrolidin-3-yl)-4-(1,3-thiazol-4-ylmethyl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

C1CN(CCC1C2=NC=CS2)C(=O)NC3CCN(C3=O)C4=CC=CC=C4

DOS

IR

Vibrations