Geometry & MOs

Info

ID:	32347
PubChem CID:	6436655
Reduced:	OC3H3 (4)
Stoich.:	AB3C3 (4)
Weight, g/mol:	391.988526
ΔH_f, kcal/mol:	-118.3
Dipole, Da:	1.24
IP(EA), eV:	-8.78(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-diazonio-2-[(Z)-2-(4-diazonio-2-sulfonatophenyl)ethenyl]benzenesulfonate

Drug info:

PubChemData

Smile

CCOC(=O)/C=C\C1=CC2=C(C=C1)OCO2

DOS

IR

Vibrations