Geometry & MOs

Info

ID:	229645
PubChem CID:	87568294
Reduced:	SO4C12H16 (1)
Stoich.:	AB4C12D16 (1)
Weight, g/mol:	256.07693
ΔH_f, kcal/mol:	-147.84
Dipole, Da:	3.98
IP(EA), eV:	-9.4(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

pent-4-en-2-yloxy 4-methylbenzenesulfonate

Drug info:

PubChemData

Smile

CCOC1=C(C=CC(=C1CC=C)C)S(=O)(=O)O

DOS

IR

Vibrations