Geometry & MOs

Info

ID:

400687

PubChem CID:

135048767

Reduced:

BPC10H15 (1)

Stoich.:

ABC10D15 (1)

Weight, g/mol:

176.092618

ΔHf, kcal/mol:

115.74

Dipole, Da:

5.77

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.754269

Charge, e:

 -1

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

[B-][PH+](C1=CC=CC=C1)C(C)(C)C

DOS

IR

Vibrations