Geometry & MOs

Info

ID:	355357
PubChem CID:	127288353
Reduced:	ON5C19H27 (1)
Stoich.:	AB5C19D27 (1)
Weight, g/mol:	327.20591
ΔH_f, kcal/mol:	1.69
Dipole, Da:	4.27
IP(EA), eV:	-8.49(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-ethylpiperidin-3-yl)-2-(5-methyl-1-phenyltriazol-4-yl)acetamide

Drug info:

PubChemData

Smile

CCN1CCCC(C1)NC(=O)CC2=C(N(N=N2)C3=CC=C(C=C3)C)C

DOS

IR

Vibrations