Geometry & MOs

Info

ID:	404296
PubChem CID:	135065764
Reduced:	FOH23C25 (1)
Stoich.:	ABC23D25 (1)
Weight, g/mol:	289.06697
ΔH_f, kcal/mol:	-11.85
Dipole, Da:	1.7
IP(EA), eV:	-8.64(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5R)-5-(chloromethyl)-2-(4-fluorophenyl)-5-phenyl-4H-1,3-oxazole

Drug info:

PubChemData

Smile

CC(=O)C(C)(C1CC1C2=CC=C(C=C2)/C=C/C3=CC4=CC=CC=C4C=C3)F

DOS

IR

Vibrations