Geometry & MOs

Info

ID:	397856
PubChem CID:	135030847
Reduced:	O3C13H14 (1)
Stoich.:	A3B13C14 (1)
Weight, g/mol:	217.110279
ΔH_f, kcal/mol:	-116.83
Dipole, Da:	3.39
IP(EA), eV:	-9.6(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1[C@@H]2CC(=O)[C@](C1O)(CC3=CC=CC=C23)O

DOS

IR

Vibrations