Geometry & MOs

Info

ID:	56531
PubChem CID:	17436132
Reduced:	Cl2N3O4H13C17 (1)
Stoich.:	A2B3C4D13E17 (1)
Weight, g/mol:	316.124549
ΔH_f, kcal/mol:	-53.14
Dipole, Da:	6.91
IP(EA), eV:	-8.81(-1.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methoxyphenyl)-2-(2-thiophen-2-ylpyrrolidin-1-yl)acetamide

Drug info:

PubChemData

Smile

C1CC(=O)N(C1)C2=C(C=C(C=C2)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])Cl

DOS

IR

Vibrations