Geometry & MOs

Info

ID:	354385
PubChem CID:	127286629
Reduced:	ON2C11H16 (2)
Stoich.:	AB2C11D16 (2)
Weight, g/mol:	367.237211
ΔH_f, kcal/mol:	-91.39
Dipole, Da:	6.46
IP(EA), eV:	-8.68(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(piperidin-1-ylmethyl)-N-[(4-pyrazol-1-ylphenyl)methyl]pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

C1CCN(CC1)CC2CCCN2C(=O)NCC3=CC(=CC=C3)N4CCCC4=O

DOS

IR

Vibrations