Geometry & MOs

Info

ID:	400755
PubChem CID:	135048996
Reduced:	BNC12H24 (1)
Stoich.:	ABC12D24 (1)
Weight, g/mol:	136.142331
ΔH_f, kcal/mol:	-2.27
Dipole, Da:	1.01
IP(EA), eV:	-8.58(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

hept-1-ynyl(dimethyl)borane

Drug info:

PubChemData

Smile

B(CC)(CC)C1=CC=CC1.CN(C)C

DOS

IR

Vibrations