Geometry & MOs

Info

ID:	368268
PubChem CID:	127327842
Reduced:	ON5C21H35 (1)
Stoich.:	AB5C21D35 (1)
Weight, g/mol:	381.252861
ΔH_f, kcal/mol:	-41.48
Dipole, Da:	2.1
IP(EA), eV:	-8.69(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-benzylpiperidin-2-yl)methyl]-3-(1-methylpyrazol-4-yl)pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)C1CCN(CC1)C(=O)NCC2=C(N=CC=C2)N3CCN(CC3)C

DOS

IR

Vibrations