Geometry & MOs

Info

ID:	410153
PubChem CID:	135082944
Reduced:	BO4C30H45 (1)
Stoich.:	AB4C30D45 (1)
Weight, g/mol:	446.18607
ΔH_f, kcal/mol:	-267.36
Dipole, Da:	2.09
IP(EA), eV:	-9.27(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S,5S)-2-[(4S,5S)-4,5-diphenyl-1,3,2-dioxaborolan-2-yl]-4,5-diphenyl-1,3,2-dioxaborolane

Drug info:

PubChemData

Smile

B1(O[C@@H]2[C@H]3CC[C@@]([C@@]2(O1)C4=CC=CC=C4)(C3(C)C)C)CC(=C(CCCC)CCCC)C(=O)OCC

DOS

IR

Vibrations