Geometry & MOs

Info

ID:	444514
PubChem CID:	135262712
Reduced:	OC17H24 (1)
Stoich.:	AB17C24 (1)
Weight, g/mol:	297.172879
ΔH_f, kcal/mol:	-30.68
Dipole, Da:	2.23
IP(EA), eV:	-9.29(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E,4E)-4-[(4-cyanophenyl)methylidene]-2-methyldec-2-enoic acid

Drug info:

PubChemData

Smile

CCCCCC/C(=C\C1=CC=CC=C1)/C=C/CO

DOS

IR

Vibrations