Geometry & MOs

Info

ID:	444515
PubChem CID:	135262713
Reduced:	NO2C19H23 (1)
Stoich.:	AB2C19D23 (1)
Weight, g/mol:	297.172879
ΔH_f, kcal/mol:	-41.78
Dipole, Da:	2.88
IP(EA), eV:	-10.05(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCCCCC/C(=C\C1=CC=C(C=C1)C#N)/C=C(\C)/C(=O)O

DOS

IR

Vibrations