Geometry & MOs

Info

ID:	340671
PubChem CID:	127262682
Reduced:	OSP2Cl4H22C36 (1)
Stoich.:	ABC2D4E22F36 (1)
Weight, g/mol:	714.186873
ΔH_f, kcal/mol:	63.48
Dipole, Da:	5.13
IP(EA), eV:	-8.43(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,6-bis(diphenylphosphanyl)-N-(3-trihydroxysilylpropyl)phenoxazine-10-carboxamide

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)Cl)P(C2=CC=C(C=C2)Cl)C3=C4C(=CC=C3)SC5=CC=CC(=C5O4)P(C6=CC=C(C=C6)Cl)C7=CC(=CC=C7)Cl

DOS

IR

Vibrations