Geometry & MOs

Info

ID:

385290

PubChem CID:

134978707

Reduced:

BN3C5H6 (1)

Stoich.:

AB3C5D6 (1)

Weight, g/mol:

118.057652

ΔHf, kcal/mol:

111.16

Dipole, Da:

6.05

IP(EA), eV:

-8.0(-1.24)

Spin(Sz, S2):

None, None

Charge, e:

-1

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

[B-](C#N)[NH+]1C=CN=C1C

DOS

IR

Vibrations