Geometry & MOs

Info

ID:	411688
PubChem CID:	135084522
Reduced:	P2O4H42C45 (1)
Stoich.:	A2B4C42D45 (1)
Weight, g/mol:	295.002908
ΔH_f, kcal/mol:	-65.01
Dipole, Da:	1.29
IP(EA), eV:	-7.98(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

potassium;(2-nitrophenyl)sulfonyl-(propan-2-ylideneamino)azanide

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)C2=CC(=CC(=C2)C)PC3=C(C4=C(C=C3)OCO4)C5=C(C=CC6=C5OCO6)P(C7=CC(=CC(=C7)C)C)C8=CC(=CC(=C8)C)C)C

DOS

IR

Vibrations