Geometry & MOs

Info

ID:

400653

PubChem CID:

135048641

Reduced:

NPB2O3F4C9H22 (1)

Stoich.:

ABC2D3E4F9G22 (1)

Weight, g/mol:

234.143036

ΔHf, kcal/mol:

-557.62

Dipole, Da:

7.82

IP(EA), eV:

-10.96(-0.06)

Spin(Sz, S2):

None, None

Charge, e:

1

Chem-info

IUPAC name:

ethylazaniumylidynemethyl(triethoxyphosphaniumyl)boranuide

Drug info:

PubChemData

Smile

[BH2-](C#[N+]CC)[P+](OCC)(OCC)OCC.[B-](F)(F)(F)F

DOS

IR

Vibrations