Geometry & MOs

Info

ID:	28833
PubChem CID:	829934
Reduced:	ON3C15H15 (1)
Stoich.:	AB3C15D15 (1)
Weight, g/mol:	279.100777
ΔH_f, kcal/mol:	43.52
Dipole, Da:	7.11
IP(EA), eV:	-8.85(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(furan-2-yl)-5-[[(1R)-1-phenylethyl]amino]-1,3-oxazole-4-carbonitrile

Drug info:

PubChemData

Smile

C1CCN(C1)C2=C(N=C(O2)CC3=CC=CC=C3)C#N

DOS

IR

Vibrations