Geometry & MOs

Info

ID:	18289
PubChem CID:	539370
Reduced:	BO3C10H19 (1)
Stoich.:	AB3C10D19 (1)
Weight, g/mol:	198.142725
ΔH_f, kcal/mol:	-224.38
Dipole, Da:	5.14
IP(EA), eV:	-10.12(0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-ethyl-4,4,6-trimethyl-1,3,2-dioxaborinan-5-yl)ethanone

Drug info:

PubChemData

Smile

B1(OC(C(C(O1)(C)C)C(=O)C)C)CC

DOS

IR

Vibrations