Geometry & MOs

Info

ID:	293467
PubChem CID:	117390429
Reduced:	NF2O4H7C11 (1)
Stoich.:	AB2C4D7E11 (1)
Weight, g/mol:	255.034314
ΔH_f, kcal/mol:	-153.87
Dipole, Da:	5.1
IP(EA), eV:	-9.58(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3,4-difluoro-2-methoxyphenyl)-1,2-oxazole-5-carboxylic acid

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1F)C2=NOC(=C2)C(=O)O)F

DOS

IR

Vibrations