Geometry & MOs

Info

ID:	412766
PubChem CID:	135085693
Reduced:	LiOC9H9 (1)
Stoich.:	ABC9D9 (1)
Weight, g/mol:	203.094629
ΔH_f, kcal/mol:	14.89
Dipole, Da:	6.97
IP(EA), eV:	-7.55(1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-5-ethyl-3-phenyl-2,3-dihydro-1,4-oxazin-6-one

Drug info:

PubChemData

Smile

[Li+].C[C@@H]1[C-](O1)C2=CC=CC=C2

DOS

IR

Vibrations