Geometry & MOs

Info

ID:	19693
PubChem CID:	570545
Reduced:	NO3H11C17 (1)
Stoich.:	AB3C11D17 (1)
Weight, g/mol:	277.073893
ΔH_f, kcal/mol:	13.74
Dipole, Da:	3.58
IP(EA), eV:	-9.17(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-phenylspiro[1,4,2-dioxazole-5,2'-naphthalene]-1'-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=NOC3(O2)C=CC4=CC=CC=C4C3=O

DOS

IR

Vibrations