Geometry & MOs

Info

ID:	199408
PubChem CID:	79242421
Reduced:	ON5C14H19 (1)
Stoich.:	AB5C14D19 (1)
Weight, g/mol:	282.081599
ΔH_f, kcal/mol:	36.63
Dipole, Da:	2.86
IP(EA), eV:	-8.06(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-3,5-difluorobenzoic acid

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C)C)CNC2=NC=CN(C2=O)C3CC3

DOS

IR

Vibrations