Geometry & MOs

Info

ID:	372223
PubChem CID:	131294434
Reduced:	SN2O3H8C9 (1)
Stoich.:	AB2C3D8E9 (1)
Weight, g/mol:	226.018998
ΔH_f, kcal/mol:	-31.15
Dipole, Da:	3.07
IP(EA), eV:	-9.4(-1.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,5-difluorophenyl)-1,2,4-oxadiazole-5-carboxylic acid

Drug info:

PubChemData

Smile

CC1=CC(=NS1)C2=C(ON=C2C)C(=O)O

DOS

IR

Vibrations