Geometry & MOs

Info

ID:	409176
PubChem CID:	135081955
Reduced:	BClSiC16H26 (1)
Stoich.:	ABCD16E26 (1)
Weight, g/mol:	288.208072
ΔH_f, kcal/mol:	-76.14
Dipole, Da:	3.97
IP(EA), eV:	-8.36(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

B1(C=C2[C@@H]3C[C@@H](C3(C)C)CC2=C([C@H]1[Si](C)(C)C)C)Cl

DOS

IR

Vibrations