Geometry & MOs

Info

ID:	240727
PubChem CID:	93617209
Reduced:	OSN2C11H16 (1)
Stoich.:	ABC2D11E16 (1)
Weight, g/mol:	321.151098
ΔH_f, kcal/mol:	-24.65
Dipole, Da:	4.16
IP(EA), eV:	-8.83(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[(2S)-2-thiophen-3-ylpyrrolidin-1-yl]acetyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

C1C[C@@H](N(C1)CCC(=O)N)C2=CSC=C2

DOS

IR

Vibrations