Geometry & MOs

Info

ID:	371513
PubChem CID:	127346752
Reduced:	OS2N5C18H25 (1)
Stoich.:	AB2C5D18E25 (1)
Weight, g/mol:	343.225977
ΔH_f, kcal/mol:	25.97
Dipole, Da:	1.54
IP(EA), eV:	-8.7(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-oxo-1-phenyl-2-[3-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]ethyl]propanamide

Drug info:

PubChemData

Smile

CN1C(=NN=C1SCC(=O)N2CCC(C2)CN3CCCC3)C4=CC=CS4

DOS

IR

Vibrations