Geometry & MOs

Info

ID:	155625
PubChem CID:	56366389
Reduced:	ClO2N4C25H27 (1)
Stoich.:	AB2C4D25E27 (1)
Weight, g/mol:	434.141262
ΔH_f, kcal/mol:	-18.2
Dipole, Da:	1.55
IP(EA), eV:	-9.11(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-methylphenyl)-5-oxo-N-[2-oxo-2-(pyridin-3-ylamino)ethyl]-2-thiophen-2-ylpyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CCCC(=O)NC1CCCN(C1)C(=O)C2=CC(=NN2C3=CC=CC=C3)C4=CC=C(C=C4)Cl

DOS

IR

Vibrations