Geometry & MOs

Info

ID:

232024

PubChem CID:

87575176

Reduced:

SeN2H6C12 (1)

Stoich.:

AB2C6D12 (1)

Weight, g/mol:

230.049843

ΔHf, kcal/mol:

118.81

Dipole, Da:

5.52

IP(EA), eV:

-8.93(-1.65)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-chloro-2-(4-phenylphenyl)acetaldehyde

Drug info:

PubChemData

Smile

C1=CC(=CC2=C1C=C[Se]2)C=C(C#N)C#N

DOS

IR

Vibrations