Geometry & MOs

Info

ID:	140525
PubChem CID:	52715008
Reduced:	ON2C10H12 (2)
Stoich.:	AB2C10D12 (2)
Weight, g/mol:	470.206639
ΔH_f, kcal/mol:	-18.94
Dipole, Da:	5.05
IP(EA), eV:	-8.88(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[2-[2-(dimethylamino)ethoxy]benzoyl]-1,5-diphenyl-1,2,4-triazole-3-carbohydrazide

Drug info:

PubChemData

Smile

CN(C)CCOC1=CC=CC=C1C(=O)NCCC2=NC3=CC=CC=C3N2

DOS

IR

Vibrations