Geometry & MOs

Info

ID:	399685
PubChem CID:	135041752
Reduced:	NO2C13H17 (1)
Stoich.:	AB2C13D17 (1)
Weight, g/mol:	244.109944
ΔH_f, kcal/mol:	-63.75
Dipole, Da:	3.34
IP(EA), eV:	-9.54(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-acetyl-3-methylidene-1H-indene-2-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)/C=N\C(=O)OCC1=CC=CC=C1

DOS

IR

Vibrations