Geometry & MOs

Info

ID:	207319
PubChem CID:	80375467
Reduced:	ON5C15H21 (1)
Stoich.:	AB5C15D21 (1)
Weight, g/mol:	261.122575
ΔH_f, kcal/mol:	12.35
Dipole, Da:	7.12
IP(EA), eV:	-8.63(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-methoxypyridin-3-yl)-5-propyl-1H-1,2,4-triazole-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=NC(=NN1)C(=O)NC2=CC=CC=C2CNC

DOS

IR

Vibrations