Geometry & MOs

Info

ID:	354501
PubChem CID:	127287050
Reduced:	ClO2N4C19H27 (1)
Stoich.:	AB2C4D19E27 (1)
Weight, g/mol:	392.197904
ΔH_f, kcal/mol:	-89.57
Dipole, Da:	6.84
IP(EA), eV:	-9.01(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(3-chloro-2-methylanilino)-3-oxopropyl]-2-(pyrrolidin-1-ylmethyl)pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1Cl)NC(=O)CCNC(=O)N2CCN3CCCCC3C2

DOS

IR

Vibrations