Geometry & MOs

Info

ID:	407435
PubChem CID:	135080097
Reduced:	IO2C12H15 (1)
Stoich.:	AB2C12D15 (1)
Weight, g/mol:	242.170207
ΔH_f, kcal/mol:	-41.32
Dipole, Da:	3.77
IP(EA), eV:	-9.61(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-6-[tert-butyl(dimethyl)silyl]oxy-4-methylhex-4-en-3-one

Drug info:

PubChemData

Smile

COC(=O)C1(C=CCC=C1)CCC(=C)I

DOS

IR

Vibrations