Geometry & MOs

Info

ID:	365576
PubChem CID:	127318069
Reduced:	O2N4C19H26 (1)
Stoich.:	A2B4C19D26 (1)
Weight, g/mol:	398.177647
ΔH_f, kcal/mol:	-63.8
Dipole, Da:	1.32
IP(EA), eV:	-8.73(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-ethyl-1,3-thiazol-2-yl)-N-(2-oxo-1-phenylpyrrolidin-3-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1CN2CCCC2CN1C(=O)NC3CCN(C3=O)C4=CC=CC=C4

DOS

IR

Vibrations