Geometry & MOs

Info

ID:	232900
PubChem CID:	87577527
Reduced:	S2O7C15H30 (1)
Stoich.:	A2B7C15D30 (1)
Weight, g/mol:	200.08373
ΔH_f, kcal/mol:	-342.48
Dipole, Da:	1.43
IP(EA), eV:	-11.12(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-phenylethenyl)penta-2,4-dienoic acid

Drug info:

PubChemData

Smile

CCCCCS(=O)(=O)CCOC(=O)OCCS(=O)(=O)CCCCC

DOS

IR

Vibrations