Geometry & MOs

Info

ID:	409684
PubChem CID:	135082467
Reduced:	BClNO2C19H31 (1)
Stoich.:	ABCD2E19F31 (1)
Weight, g/mol:	278.168939
ΔH_f, kcal/mol:	-195.06
Dipole, Da:	5.5
IP(EA), eV:	-10.41(0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-methoxyphenyl)methoxymethyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Drug info:

PubChemData

Smile

B1(O[C@@H]([C@H](O1)C2CCCCC2)C3CCCCC3)[C@@H](CC(C)C#N)Cl

DOS

IR

Vibrations