Geometry & MOs

Info

ID:	385384
PubChem CID:	134978934
Reduced:	BClC4H6 (1)
Stoich.:	ABC4D6 (1)
Weight, g/mol:	108.111031
ΔH_f, kcal/mol:	-30.62
Dipole, Da:	1.21
IP(EA), eV:	-9.72(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3,4-trimethyl-2,5-dihydroborole

Drug info:

PubChemData

Smile

B1(CC=CC1)Cl

DOS

IR

Vibrations