Geometry & MOs

Info

ID:	147998
PubChem CID:	53787660
Reduced:	NO2F3H14C16 (1)
Stoich.:	AB2C3D14E16 (1)
Weight, g/mol:	470.184172
ΔH_f, kcal/mol:	-170.5
Dipole, Da:	0.94
IP(EA), eV:	-10.45(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-[2-(4,5-diphenyl-1,3-oxazol-2-yl)-3-(methylamino)-3-oxopropyl]phenoxy]propanoic acid

Drug info:

PubChemData

Smile

C1CC(CCC1C=C(C#N)F)OC(=O)C2=CC(=C(C=C2)F)F

DOS

IR

Vibrations