Geometry & MOs

Info

ID:	356753
PubChem CID:	127292234
Reduced:	O3N4C15H28 (1)
Stoich.:	A3B4C15D28 (1)
Weight, g/mol:	351.209282
ΔH_f, kcal/mol:	-146.97
Dipole, Da:	2.82
IP(EA), eV:	-8.67(0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-ethylpiperazin-1-yl)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1C(=O)NCCN1C(=O)NCC(C(C)C)N2CCOCC2

DOS

IR

Vibrations