Geometry & MOs

Info

ID:	411076
PubChem CID:	135083886
Reduced:	O3C11H16 (1)
Stoich.:	A3B11C16 (1)
Weight, g/mol:	222.074592
ΔH_f, kcal/mol:	-99.76
Dipole, Da:	3.02
IP(EA), eV:	-9.88(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(Z)-4-trimethylsilylbut-3-enyl] methanesulfonate

Drug info:

PubChemData

Smile

CC(CCC#C/C(=C/C(=O)OC)/C)O

DOS

IR

Vibrations