Geometry & MOs

Info

ID:	444735
PubChem CID:	135263398
Reduced:	SO4C10H10 (1)
Stoich.:	AB4C10D10 (1)
Weight, g/mol:	258.16198
ΔH_f, kcal/mol:	-155.16
Dipole, Da:	5.2
IP(EA), eV:	-10.16(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E,4E)-4-benzylidenedec-2-enoic acid

Drug info:

PubChemData

Smile

C1C2=C(CS1(=O)=O)C=C(C=C2)CC(=O)O

DOS

IR

Vibrations