Geometry & MOs

Info

ID:	362624
PubChem CID:	127308892
Reduced:	ON5C22H31 (1)
Stoich.:	AB5C22D31 (1)
Weight, g/mol:	381.252861
ΔH_f, kcal/mol:	3.4
Dipole, Da:	1.92
IP(EA), eV:	-8.74(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-benzylpiperidin-3-yl)-3-(4-methylpyrazol-1-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=CN(N=C1)C2CCCN(C2)C(=O)NCC(C)N3CCC4=CC=CC=C4C3

DOS

IR

Vibrations