Geometry & MOs

Info

ID:	217533
PubChem CID:	85087958
Reduced:	SO6C18H28 (1)
Stoich.:	AB6C18D28 (1)
Weight, g/mol:	372.13953
ΔH_f, kcal/mol:	-258.75
Dipole, Da:	6.12
IP(EA), eV:	-9.9(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-phenylmethoxyhepta-4,6-dienyl 4-methylbenzenesulfonate

Drug info:

PubChemData

Smile

CCOC(=O)C(C(C)C(C(C)C)OCOC)S(=O)(=O)C1=CC=CC=C1

DOS

IR

Vibrations