Geometry & MOs

Info

ID:	21382
PubChem CID:	588068
Reduced:	ClO2N4H9C10 (1)
Stoich.:	AB2C4D9E10 (1)
Weight, g/mol:	252.041403
ΔH_f, kcal/mol:	20.53
Dipole, Da:	7.01
IP(EA), eV:	-9.62(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-chlorophenoxy)-N-(1,2,4-triazol-4-yl)acetamide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1OCC(=O)NN2C=NN=C2)Cl

DOS

IR

Vibrations