Geometry & MOs

Info

ID:	400568
PubChem CID:	135048381
Reduced:	BO6C39H75 (1)
Stoich.:	AB6C39D75 (1)
Weight, g/mol:	216.168545
ΔH_f, kcal/mol:	-432.42
Dipole, Da:	2.42
IP(EA), eV:	-9.88(0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

butoxy-(2,5-dimethylphenyl)-ethenylborane

Drug info:

PubChemData

Smile

B(CC(C)CCCCCCCCC(=O)OC)(CC(C)CCCCCCCCC(=O)OC)CC(C)CCCCCCCCC(=O)OC

DOS

IR

Vibrations