Geometry & MOs

Info

ID:	269046
PubChem CID:	103608377
Reduced:	ClOF3N3H7C12 (1)
Stoich.:	ABC3D3E7F12 (1)
Weight, g/mol:	156.064726
ΔH_f, kcal/mol:	-136.1
Dipole, Da:	2.21
IP(EA), eV:	-9.45(-1.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC(=C(N=C1)Cl)NC(=O)C2=NC=C(C=C2)C(F)(F)F

DOS

IR

Vibrations