Geometry & MOs

Info

ID:	409175
PubChem CID:	135081954
Reduced:	BOC10H19 (1)
Stoich.:	ABC10D19 (1)
Weight, g/mol:	292.158535
ΔH_f, kcal/mol:	-100.73
Dipole, Da:	1.4
IP(EA), eV:	-9.47(1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1R,5S,9R)-4-chloro-6,10,10-trimethyl-4-boratricyclo[7.1.1.02,7]undeca-2,6-dien-5-yl]-trimethylsilane

Drug info:

PubChemData

Smile

B1([C@@H](CCC1C)C)OCC(=C)C

DOS

IR

Vibrations