Geometry & MOs

Info

ID:	409629
PubChem CID:	135082411
Reduced:	BC14H17 (1)
Stoich.:	AB14C17 (1)
Weight, g/mol:	354.345782
ΔH_f, kcal/mol:	5.25
Dipole, Da:	0.26
IP(EA), eV:	-8.54(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

bis[(1S,2R,3S,5S)-2-ethyl-6,6-dimethyl-3-bicyclo[3.1.1]heptanyl]-prop-2-enylborane

Drug info:

PubChemData

Smile

B1(CC2=C(C1)CCCC2)C3=CC=CC=C3

DOS

IR

Vibrations