Geometry & MOs

Info

ID:	28545
PubChem CID:	828296
Reduced:	O3C20H20 (1)
Stoich.:	A3B20C20 (1)
Weight, g/mol:	295.076216
ΔH_f, kcal/mol:	-78.01
Dipole, Da:	2.52
IP(EA), eV:	-8.99(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

12-methoxy-7H-benzo[a]phenophosphazinine 12-oxide

Drug info:

PubChemData

Smile

CC(=O)C1=C(C2=CC=CC=C2C=C1)OC(=O)C3[C@H]4[C@@H]3CCCC4

DOS

IR

Vibrations