Bis(N-tosylpyrrolo[3,4-d])tetrathiafulvalene

SpectraBase Compound ID	79Pboofc4y5
InChI	InChI=1S/C24H18N2O4S6/c1-15-3-7-17(8-4-15)35(27,28)25-11-19-20(12-25)32-23(31-19)24-33-21-13-26(14-22(21)34-24)36(29,30)18-9-5-16(2)6-10-18/h3-14H,1-2H3
InChIKey	MTDCVOGIJPBSDK-UHFFFAOYSA-N Google Search
Mol Weight	590.8 g/mol
Molecular Formula	C24H18N2O4S6
Exact Mass	589.959084 g/mol

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SpectraBase Spectrum ID	BPXUj7sZr3i
Name	Bis(N-tosylpyrrolo[3,4-d])tetrathiafulvalene
Alternate Name(s)	5-(p-tolylsulfonyl)-2-[5-(p-tolylsulfonyl)-[1,3]dithiolo[4,5-c]pyrrol-2-ylidene]-[1,3]dithiolo[4,5-c]pyrrole 5-(4-Methylphenyl)sulfonyl-2-[5-(4-methylphenyl)sulfonyl-[1,3]dithiolo[4,5-c]pyrrol-2-ylidene]-[1,3]dithiolo[4,5-c]pyrrole
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C24H18N2O4S6
InChI	InChI=1S/C24H18N2O4S6/c1-15-3-7-17(8-4-15)35(27,28)25-11-19-20(12-25)32-23(31-19)24-33-21-13-26(14-22(21)34-24)36(29,30)18-9-5-16(2)6-10-18/h3-14H,1-2H3
InChIKey	MTDCVOGIJPBSDK-UHFFFAOYSA-N
Molecular Weight	590.778 g/mol
SMILES	c1[n](S(c2ccc(cc2)C)(=O)=O)cc2SC(Sc12)=C1Sc2c[n](S(c3ccc(cc3)C)(=O)=O)cc2S1
SPLASH	splash10-001u-0090770000-dde009061f328e719806
Source of Spectrum	J-65-5801-18
Wiley ID	1533179