Dataset

19F nuclear magnetic resonance spectroscopy (19F NMR)

Chemical Info

InChI	InChI=1S/2C18H15P.C17H12F2NP.2Cu.2HI/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;18-13-4-8-15(9-5-13)21(17-3-1-2-12-20-17)16-10-6-14(19)7-11-16;;;;/h2*1-15H;1-12H;;;2*1H/q;;;2*+1;;/p-2
SMILES	c1ccc(cc1)P(c1ccccc1)c1ccccc1.c1ccc(cc1)P(c1ccccc1)c1ccccc1.Fc1ccc(cc1)P(c1ccccn1)c1ccc(cc1)F.[Cu]I.[Cu]I
InChI Key	XJPGGGQOGSIZDY-UHFFFAOYSA-L
Molecular Formula	C53H42Cu2F2I2NP3
Exact Mass	1204.726 g/mol

Data and Resources

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Metadata Information

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• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/XJPGGGQOGSIZDY-UHFFFAOYSA-L/CHMO0000597
License URL
Source	https://www.chemotion-repository.net/inchikey/XJPGGGQOGSIZDY-UHFFFAOYSA-L/CHMO0000597
Version
Author	Olaf Fuhr
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T04:02:24.862026
MetadataModified	2024-09-07T19:07:46.750626
MetadataPublished	2020-10-29

Field	Value
Measurement Technique	19F nuclear magnetic resonance spectroscopy
Measurement Variables

Data-Source Molecule ID	Data-Source
154733604	PubChem
The data in this table is sourced from UniChem at EBI.