Geometry & MOs

Info

ID:	233663
PubChem CID:	91148344
Reduced:	ClNO5H16C21 (1)
Stoich.:	ABC5D16E21 (1)
Weight, g/mol:	453.993565
ΔH_f, kcal/mol:	-61.62
Dipole, Da:	6.59
IP(EA), eV:	-9.74(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[[amino-[amino-(phenylsulfanylperoxyamino)phosphoryl]oxyphosphoryl]amino]peroxysulfanylbenzene

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CCC(=O)OC2=CC=CC(=C2)OC3=C(C=C(C=C3)[N+](=O)[O-])Cl

DOS

IR

Vibrations