Geometry & MOs

Info

ID:

389066

PubChem CID:

134991056

Reduced:

BNC10H23 (1)

Stoich.:

ABC10D23 (1)

Weight, g/mol:

830.22087

ΔHf, kcal/mol:

38.49

Dipole, Da:

5.74

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.755678

Charge, e:

 0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

[B-][N+](CC)(CC(C)C)C(C)(C)C

DOS

IR

Vibrations