Geometry & MOs

Info

ID:	412877
PubChem CID:	135085811
Reduced:	BrNO3C8H12 (1)
Stoich.:	ABC3D8E12 (1)
Weight, g/mol:	189.078979
ΔH_f, kcal/mol:	-73.38
Dipole, Da:	1.93
IP(EA), eV:	-9.6(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-5-phenyl-2,3-dihydro-1,4-oxazin-6-one

Drug info:

PubChemData

Smile

CCOC(=O)C(=NOC)/C=C/CBr

DOS

IR

Vibrations