Geometry & MOs

Info

ID:	348130
PubChem CID:	127273192
Reduced:	ON4C14H20 (1)
Stoich.:	AB4C14D20 (1)
Weight, g/mol:	265.19026
ΔH_f, kcal/mol:	3.92
Dipole, Da:	3.7
IP(EA), eV:	-9.07(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,4-dimethyl-N-[1-(4-methyl-1,2,4-triazol-3-yl)ethyl]piperidine-1-carboxamide

Drug info:

PubChemData

Smile

C1CC1N2CCC(C2)NC(=O)NCC3=CC=NC=C3

DOS

IR

Vibrations