Geometry & MOs

Info

ID:	203486
PubChem CID:	79837132
Reduced:	F2N2O3C11H12 (1)
Stoich.:	A2B2C3D11E12 (1)
Weight, g/mol:	257.08635
ΔH_f, kcal/mol:	-201.07
Dipole, Da:	3.08
IP(EA), eV:	-9.4(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-difluoro-4-(oxan-4-ylamino)benzoic acid

Drug info:

PubChemData

Smile

CC(C(=O)N)NC1=C(C(=C(C=C1)C(=O)OC)F)F

DOS

IR

Vibrations