Geometry & MOs

Info

ID:	391186
PubChem CID:	135003420
Reduced:	O3H16C18 (1)
Stoich.:	A3B16C18 (1)
Weight, g/mol:	269.177964
ΔH_f, kcal/mol:	-59.08
Dipole, Da:	1.73
IP(EA), eV:	-8.47(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3E)-3-[(E)-oct-3-en-2-ylidene]-2H-indol-1-yl]ethanone

Drug info:

PubChemData

Smile

CC1=C(OC2=CC=CC(=C12)C(=O)C)C3=CC=C(C=C3)OC

DOS

IR

Vibrations