Geometry & MOs

Info

ID:

385175

PubChem CID:

134978450

Reduced:

C3H4 (5)

Stoich.:

A3B4 (5)

Weight, g/mol:

271.084458

ΔHf, kcal/mol:

51.95

Dipole, Da:

0.54

IP(EA), eV:

-9.2(1.2)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

5-[(E)-2-(4-methoxyphenyl)ethenyl]-2-nitrophenol

Drug info:

PubChemData

Smile

C1CCC#CC2CCCCC2C#CCC1

DOS

IR

Vibrations