Geometry & MOs

Info

ID:	386961
PubChem CID:	134983516
Reduced:	IC16H27 (1)
Stoich.:	AB16C27 (1)
Weight, g/mol:	426.294549
ΔH_f, kcal/mol:	-23.96
Dipole, Da:	2.55
IP(EA), eV:	-8.87(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(9-borabicyclo[3.3.1]nonan-9-yloxy)-3-phenyl-3-trimethylsilylpent-4-enyl]-trimethylsilane

Drug info:

PubChemData

Smile

CCCCCCC/C=C/1\CC(CC(=C1)I)(C)C

DOS

IR

Vibrations