Geometry & MOs

Info

ID:	407280
PubChem CID:	135079739
Reduced:	NO6C14H19 (1)
Stoich.:	AB6C14D19 (1)
Weight, g/mol:	335.142939
ΔH_f, kcal/mol:	-263.0
Dipole, Da:	5.53
IP(EA), eV:	-10.13(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

(1Z)-2-hydroxy-6-methyl-1-(2,4,6-trimethylphenyl)sulfonylhepta-1,5-diene-1-diazonium

Drug info:

PubChemData

Smile

CCCC1=C(NC(=C1C(=O)O)C(=O)OCC)C(=O)OCC

DOS

IR

Vibrations