Geometry & MOs

Info

ID:	130859
PubChem CID:	51118875
Reduced:	N2O4C21H26 (1)
Stoich.:	A2B4C21D26 (1)
Weight, g/mol:	423.252192
ΔH_f, kcal/mol:	-120.59
Dipole, Da:	3.7
IP(EA), eV:	-8.85(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(2-phenoxyethoxymethyl)phenyl]-3-pyrrolidin-1-ylpiperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1CN(CCO1)C(=O)NC2=CC=CC(=C2)COCCOC3=CC=CC=C3

DOS

IR

Vibrations