Geometry & MOs

Info

ID:	400726
PubChem CID:	135048895
Reduced:	BO2C15H22 (1)
Stoich.:	AB2C15D22 (1)
Weight, g/mol:	302.296839
ΔH_f, kcal/mol:	-75.77
Dipole, Da:	1.81
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.753896
Charge, e:	0

Chem-info

IUPAC name:

lithium;3,3-dimethylbut-1-ynyl-hexyl-di(propan-2-yloxy)boranuide

Drug info:

PubChemData

Smile

[B-](C)(C#CC1=CC=CC=C1)(OC(C)C)OC(C)C

DOS

IR

Vibrations