Geometry & MOs

Info

ID:	45974
PubChem CID:	10519942
Reduced:	NO4H17C19 (1)
Stoich.:	AB4C17D19 (1)
Weight, g/mol:	323.094629
ΔH_f, kcal/mol:	-76.56
Dipole, Da:	2.27
IP(EA), eV:	-8.81(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-phenylphenanthro[9,10-b][1,4]oxazin-2-one

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CCNC(=O)C(=O)C2=CC3=CC=CC=C3O2

DOS

IR

Vibrations