Geometry & MOs

Info

ID:	74090
PubChem CID:	48421447
Reduced:	O2N5C20H27 (1)
Stoich.:	A2B5C20D27 (1)
Weight, g/mol:	331.225977
ΔH_f, kcal/mol:	-23.3
Dipole, Da:	2.62
IP(EA), eV:	-8.67(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,5-dimethylpyrrolidin-1-yl)-N-(3-methoxyphenyl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1CCC(N1C2CCCN(C2)C(=O)NC3=CC=CC(=C3)C4=NN=CO4)C

DOS

IR

Vibrations