Geometry & MOs

Info

ID:	413088
PubChem CID:	135086032
Reduced:	O3C14H16 (1)
Stoich.:	A3B14C16 (1)
Weight, g/mol:	226.21041
ΔH_f, kcal/mol:	-94.53
Dipole, Da:	3.68
IP(EA), eV:	-9.84(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

bis(2,2-dimethylpropoxy)-prop-2-enylborane

Drug info:

PubChemData

Smile

C/C=C/C(=O)OC[C@H](C)C1=CC=CC=C1C=O

DOS

IR

Vibrations