Geometry & MOs

Info

ID:	230334
PubChem CID:	87570670
Reduced:	O3N4H20C21 (1)
Stoich.:	A3B4C20D21 (1)
Weight, g/mol:	593.070969
ΔH_f, kcal/mol:	-3.22
Dipole, Da:	4.08
IP(EA), eV:	-8.92(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

bis[bis(4-nitrophenyl)methoxy]-oxophosphanium

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)/C(=N/O)/N)NC(=O)C2=CC=C(C=C2)OCC3=CC=CC=N3

DOS

IR

Vibrations