Dataset

X-ray diffraction (XRD)

Chemical Info

InChI	InChI=1S/C28H18Cl3NO/c29-23-17-24(30)27(25(31)18-23)28(33)32(19-21-11-5-2-6-12-21)26-14-8-7-13-22(26)16-15-20-9-3-1-4-10-20/h1-14,17-18H,19H2
SMILES	Clc1cc(Cl)c(c(c1)Cl)C(=O)N(c1ccccc1C#Cc1ccccc1)Cc1ccccc1
InChI Key	TZLIFUSNVCRDQA-UHFFFAOYSA-N
Molecular Formula	C28H18Cl3NO
Exact Mass	490.808 g/mol

Data and Resources

• X-ray diffraction (XRD)HTML
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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/TZLIFUSNVCRDQA-UHFFFAOYSA-N/CHMO0000156
License URL
Source	https://www.chemotion-repository.net/inchikey/TZLIFUSNVCRDQA-UHFFFAOYSA-N/CHMO0000156
Version
Author	Helena Šimek
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T08:08:07.206941
MetadataModified	2024-09-08T00:02:55.339410
MetadataPublished	2022-12-20

Field	Value
Measurement Technique	X-ray diffraction
Measurement Variables

Data-Source Molecule ID	Data-Source
166175715	PubChem
The data in this table is sourced from UniChem at EBI.