Geometry & MOs

Info

ID:	218483
PubChem CID:	85089520
Reduced:	O2C15H24 (2)
Stoich.:	A2B15C24 (2)
Weight, g/mol:	471.088325
ΔH_f, kcal/mol:	-168.23
Dipole, Da:	6.2
IP(EA), eV:	-8.95(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,4-dichlorophenyl)-N-methyl-N-[1-(3-nitrophenyl)-2-pyrrolidin-1-ylethyl]acetamide;hydrochloride

Drug info:

PubChemData

Smile

CC(C)C1CCC2(C1C3CCC4C5(CCC(=O)OC(C5CCC4(C3(CC2)C)C)(C)C)C)C(=O)O

DOS

IR

Vibrations