Geometry & MOs

Info

ID:	385554
PubChem CID:	134979395
Reduced:	NOC14H22 (2)
Stoich.:	ABC14D22 (2)
Weight, g/mol:	370.16787
ΔH_f, kcal/mol:	-12.77
Dipole, Da:	1.04
IP(EA), eV:	-8.34(0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(Z)-1-bromo-5-methylideneundec-3-en-4-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Drug info:

PubChemData

Smile

COC(C1=C[C@H]2CC/C=C\CCCCN3CC[C@@H]1C4(C3)C2N5CCCC/C=C\[C@H]5C4)OC

DOS

IR

Vibrations