Geometry & MOs

Info

ID:

413012

PubChem CID:

135085956

Reduced:

N2C6H7 (2)

Stoich.:

A2B6C7 (2)

Weight, g/mol:

490.146347

ΔHf, kcal/mol:

136.73

Dipole, Da:

4.9

IP(EA), eV:

-8.28(-0.06)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

N-[2-(2-azidophenyl)ethynyl]-4-methyl-N-[2-[(Z)-2-phenylethenyl]phenyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CNC1=CC=CC=C1C#CCCCN=[N+]=[N-]

DOS

IR

Vibrations