Geometry & MOs

Info

ID:	366668
PubChem CID:	127320197
Reduced:	SO3N5C18H27 (1)
Stoich.:	AB3C5D18E27 (1)
Weight, g/mol:	379.167811
ΔH_f, kcal/mol:	-119.43
Dipole, Da:	4.4
IP(EA), eV:	-9.24(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[(1-acetylpiperidin-4-yl)amino]-2-oxoethyl]-N-(1,3-thiazol-2-yl)pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC1CCCCC1NC(=O)NC(=O)CN2CCCC2C(=O)NC3=NC=CS3

DOS

IR

Vibrations