Geometry & MOs

Info

ID:	260662
PubChem CID:	103199248
Reduced:	NF3O3H10C13 (1)
Stoich.:	AB3C3D10E13 (1)
Weight, g/mol:	251.076928
ΔH_f, kcal/mol:	-230.41
Dipole, Da:	8.24
IP(EA), eV:	-9.75(-1.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methylbutan-2-yl)-4-(trifluoromethyl)-1,3-oxazole-5-carboxylic acid

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)C2=NC(=C(O2)C(=O)O)C(F)(F)F

DOS

IR

Vibrations