Geometry & MOs

Info

ID:	354095
PubChem CID:	127286025
Reduced:	O2N5C17H31 (1)
Stoich.:	A2B5C17D31 (1)
Weight, g/mol:	314.185509
ΔH_f, kcal/mol:	-94.3
Dipole, Da:	3.24
IP(EA), eV:	-8.34(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-1-[2-(1-phenyltetrazol-5-yl)ethyl]piperidine-2-carboxamide

Drug info:

PubChemData

Smile

CC1CCC(N1CCN2CCN(CC2)CCN3C(=O)CNC3=O)C

DOS

IR

Vibrations