Geometry & MOs

Info

ID:	438479
PubChem CID:	135228221
Reduced:	NOF2H9C10 (1)
Stoich.:	ABC2D9E10 (1)
Weight, g/mol:	207.105942
ΔH_f, kcal/mol:	-100.75
Dipole, Da:	1.43
IP(EA), eV:	-9.85(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-4-(4-fluorophenyl)-2-propan-2-yl-4,5-dihydro-1,3-oxazole

Drug info:

PubChemData

Smile

CC1=NC(CO1)C2=C(C=CC(=C2)F)F

DOS

IR

Vibrations