Geometry & MOs

Info

ID:	400530
PubChem CID:	135048257
Reduced:	IO2C6H9 (1)
Stoich.:	AB2C6D9 (1)
Weight, g/mol:	308.08084
ΔH_f, kcal/mol:	-76.57
Dipole, Da:	2.53
IP(EA), eV:	-9.71(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

diethyl-[(Z)-3-iodohept-3-en-4-yl]oxyborane

Drug info:

PubChemData

Smile

C1CC([C@@H]2[C@H]1OCO2)I

DOS

IR

Vibrations