Geometry & MOs

Info

ID:	293623
PubChem CID:	117394584
Reduced:	N4C15H20 (1)
Stoich.:	A4B15C20 (1)
Weight, g/mol:	256.168797
ΔH_f, kcal/mol:	64.19
Dipole, Da:	1.8
IP(EA), eV:	-8.9(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[4-(4-methyltriazol-2-yl)phenyl]methyl]piperidine

Drug info:

PubChemData

Smile

CC1=NN(N=C1)C2=CC=CC=C2CC3CCCCN3

DOS

IR

Vibrations