Geometry & MOs

Info

ID:	259123
PubChem CID:	103158271
Reduced:	SN2O6C10H18 (1)
Stoich.:	AB2C6D10E18 (1)
Weight, g/mol:	268.215078
ΔH_f, kcal/mol:	-269.89
Dipole, Da:	4.53
IP(EA), eV:	-10.37(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(3-cyclopentyl-2-hydroxypropyl)amino]-1-pyrrolidin-1-ylpropan-1-one

Drug info:

PubChemData

Smile

COC(CC(=O)O)CNC(=O)NC1CCS(=O)(=O)C1

DOS

IR

Vibrations