Geometry & MOs

Info

ID:	397784
PubChem CID:	135030727
Reduced:	NO3C9H17 (1)
Stoich.:	AB3C9D17 (1)
Weight, g/mol:	281.105193
ΔH_f, kcal/mol:	-159.92
Dipole, Da:	1.9
IP(EA), eV:	-9.61(0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC(=O)[C@@H]1[C@H](CCC[C@@H]1O)N

DOS

IR

Vibrations