Geometry & MOs

Info

ID:	122192
PubChem CID:	50797661
Reduced:	NOC11H13 (2)
Stoich.:	ABC11D13 (2)
Weight, g/mol:	342.140199
ΔH_f, kcal/mol:	-69.06
Dipole, Da:	2.3
IP(EA), eV:	-8.64(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-ethylphenyl)-2-oxo-N-(2-thiophen-2-ylethyl)pyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)N2CCC(C2=O)C(=O)NCCC3=CC=CC=C3C

DOS

IR

Vibrations