Geometry & MOs

Info

ID:	156583
PubChem CID:	56371232
Reduced:	O2N3C23H33 (1)
Stoich.:	A2B3C23D33 (1)
Weight, g/mol:	399.252192
ΔH_f, kcal/mol:	-93.44
Dipole, Da:	7.99
IP(EA), eV:	-8.72(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cycloheptylpyrrolidin-3-yl)-1-(3-methoxyphenyl)-5-oxopyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CCC(=O)N1CCC2=C1C=CC(=C2)C(=O)NC3CCN(C3)C4CCCCCC4

DOS

IR

Vibrations