Geometry & MOs

Info

ID:	205973
PubChem CID:	80185226
Reduced:	O2N4C9H14 (1)
Stoich.:	A2B4C9D14 (1)
Weight, g/mol:	238.066617
ΔH_f, kcal/mol:	-53.58
Dipole, Da:	6.77
IP(EA), eV:	-9.48(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,6-difluorophenyl)-N-(1H-1,2,4-triazol-5-yl)acetamide

Drug info:

PubChemData

Smile

C1CCOC(C1)CC(=O)NC2=NC=NN2

DOS

IR

Vibrations