Geometry & MOs

Info

ID:	342869
PubChem CID:	127266032
Reduced:	ON2C15H18 (1)
Stoich.:	AB2C15D18 (1)
Weight, g/mol:	291.20591
ΔH_f, kcal/mol:	92.8
Dipole, Da:	3.23
IP(EA), eV:	-8.3(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-cyclopropyl-2-methyl-N-(1-piperidin-1-ylpropan-2-yl)-1,2,4-triazole-3-carboxamide

Drug info:

PubChemData

Smile

C=CC(=O)N1CCCN2C(C1)CC3=CC=CC=C32

DOS

IR

Vibrations