Geometry & MOs

Info

ID:	400750
PubChem CID:	135048974
Reduced:	BPC12H28 (1)
Stoich.:	ABC12D28 (1)
Weight, g/mol:	570.427797
ΔH_f, kcal/mol:	11.41
Dipole, Da:	5.52
IP(EA), eV:	-6.42(0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(Z)-2-(1-ethoxypropoxy)-1-phenylsulfanylethenoxy]-bis[[(1S,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]methyl]borane

Drug info:

PubChemData

Smile

[BH-][P+](CCCC)(CCCC)CCCC

DOS

IR

Vibrations