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Home > Indoles and Oxindole > 1137967-28-2
1137967-28-2 | (Z)-FeCP-Oxindole
CAS No: 1137967-28-2 Catalog No: AG01DZOD MDL No:
Product Description
Catalog Number:
AG01DZOD
Chemical Name:
(Z)-FeCP-Oxindole
CAS Number:
1137967-28-2
Molecular Formula:
C19H15FeNO
Molecular Weight:
329.1735
IUPAC Name:
cyclopenta-1,3-diene;3-(cyclopenta-2,4-dien-1-ylidenemethyl)-1H-indol-2-olate;iron(2+)
InChI:
InChI=1S/C14H11NO.C5H5.Fe/c16-14-12(9-10-5-1-2-6-10)11-7-3-4-8-13(11)15-14;1-2-4-5-3-1;/h1-9,15-16H;1-5H;/q;-1;+2/p-1
InChI Key:
MTGBTDOTYGXLBK-UHFFFAOYSA-M
SMILES:
[CH-]1C=CC=C1.O=C1Nc2c(/C/1=C/C1=CC=C[CH-]1)cccc2.[Fe+2]
Properties
Complexity:
353
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
329.05g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
329.18g/mol
Monoisotopic Mass:
329.05g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
| Title | Journal |
|---|---|
| Structural and biological investigation of ferrocene-substituted 3-methylidene-1,3-dihydro-2H-indol-2-ones. | Dalton transactions (Cambridge, England : 2003) 20090214 |
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