Geometry & MOs

Info

ID:

390264

PubChem CID:

134998127

Reduced:

N3C17H18 (1)

Stoich.:

A3B17C18 (1)

Weight, g/mol:

497.83408

ΔHf, kcal/mol:

87.42

Dipole, Da:

3.63

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.811767

Charge, e:

 0

Chem-info

IUPAC name:

4,7-diphenoxy-1,2,3-benzotriselenole

Drug info:

PubChemData

Smile

CC1=CC=CC=C1[N+]2=C(N(N=C2C)C3=CC=CC=C3)C

DOS

IR

Vibrations