Geometry & MOs

Info

ID:	22476
PubChem CID:	597355
Reduced:	BO2C12H23 (1)
Stoich.:	AB2C12D23 (1)
Weight, g/mol:	210.17911
ΔH_f, kcal/mol:	-187.54
Dipole, Da:	1.73
IP(EA), eV:	-9.27(0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-4-methyl-4,6-dipropyl-1,3,2-dioxaborinine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations