Geometry & MOs

Info

ID:	448275
PubChem CID:	135289822
Reduced:	F3O3C13H13 (1)
Stoich.:	A3B3C13D13 (1)
Weight, g/mol:	267.090686
ΔH_f, kcal/mol:	-252.59
Dipole, Da:	3.76
IP(EA), eV:	-10.53(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-4-(4-fluorobenzoyl)-2,2-dimethyl-1,3-oxazolidine-3-carboxylic acid

Drug info:

PubChemData

Smile

CCOC(=O)CC(C)C(=O)C1=CC(=C(C(=C1)F)F)F

DOS

IR

Vibrations