Geometry & MOs

Info

ID:	410169
PubChem CID:	135082960
Reduced:	BC24H41 (1)
Stoich.:	AB24C41 (1)
Weight, g/mol:	352.330131
ΔH_f, kcal/mol:	-42.28
Dipole, Da:	0.84
IP(EA), eV:	-9.25(0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methylidenebut-3-enyl-bis[(1S,2R,3S,5S)-2,6,6-trimethyl-3-bicyclo[3.1.1]heptanyl]borane

Drug info:

PubChemData

Smile

B(C/C=C\C)([C@@H]1C[C@@H]2[C@@H](C2(C)C)C[C@H]1C)[C@@H]3C[C@@H]4[C@@H](C4(C)C)C[C@H]3C

DOS

IR

Vibrations