Geometry & MOs

Info

ID:

9205

PubChem CID:

87151

Reduced:

NO2H11C12 (1)

Stoich.:

AB2C11D12 (1)

Weight, g/mol:

201.078979

ΔHf, kcal/mol:

-47.7

Dipole, Da:

0.62

IP(EA), eV:

-9.2(-0.9)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-(1-acetylindol-3-yl)ethanone

Drug info:

PubChemData

Smile

CC(=O)C1=CN(C2=CC=CC=C21)C(=O)C

DOS

IR

Vibrations