Geometry & MOs

Info

ID:	413816
PubChem CID:	135086766
Reduced:	OC18H18 (1)
Stoich.:	AB18C18 (1)
Weight, g/mol:	245.105193
ΔH_f, kcal/mol:	35.69
Dipole, Da:	4.03
IP(EA), eV:	-8.96(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-acetylindol-3-yl)ethyl acetate

Drug info:

PubChemData

Smile

CC(=O)/C(=C/C1=CC=CC=C1)/C#CC2=CCCCC2

DOS

IR

Vibrations