Geometry & MOs

Info

ID:	242148
PubChem CID:	96026615
Reduced:	FNO4C13H16 (1)
Stoich.:	ABC4D13E16 (1)
Weight, g/mol:	193.053907
ΔH_f, kcal/mol:	-198.35
Dipole, Da:	3.78
IP(EA), eV:	-9.01(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(S)-(4-fluorophenyl)-(1,3-oxazol-2-yl)methanol

Drug info:

PubChemData

Smile

COC1=C(C2=C(CCN[C@H]2[C@@H](CC(=O)O)O)C=C1)F

DOS

IR

Vibrations