Geometry & MOs

Info

ID:

390405

PubChem CID:

134999002

Reduced:

InBr2C3H3 (1)

Stoich.:

AB2C3D3 (1)

Weight, g/mol:

243.125929

ΔHf, kcal/mol:

14.77

Dipole, Da:

3.03

IP(EA), eV:

-10.45(-1.97)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

7,8-dimethoxy-10-methyl-5,10-dihydropyrrolo[1,2-b]isoquinoline

Drug info:

PubChemData

Smile

C=C=C[In](Br)Br

DOS

IR

Vibrations