Dataset

X-ray diffraction (XRD)

Chemical Info

InChI	InChI=1S/C64H20F28N8.Zn/c65-41-17-37-38(18-42(41)66)51-93-49(37)95-53-45-33(21-5-25(57(69,70)71)13-26(6-21)58(72,73)74)1-2-34(22-7-27(59(75,76)77)14-28(8-22)60(78,79)80)46(45)54(99-53)96-50-39-19-43(67)44(68)20-40(39)52(94-50)98-56-48-36(24-11-31(63(87,88)89)16-32(12-24)64(90,91)92)4-3-35(47(48)55(97-51)100-56)23-9-29(61(81,82)83)15-30(10-23)62(84,85)86;/h1-20H;/q-2;+2
SMILES	Fc1cc2/C/3=N/c4c5c(ccc(c5c5n4[Zn]n4/c(=N\C(=N3)c2cc1F)/c1c(ccc(c1/c/4=N/C1=N/C(=N\5)/c2cc(F)c(cc12)F)c1cc(cc(c1)C(F)(F)F)C(F)(F)F)c1cc(cc(c1)C(F)(F)F)C(F)(F)F)c1cc(cc(c1)C(F)(F)F)C(F)(F)F)c1cc(cc(c1)C(F)(F)F)C(F)(F)F
InChI Key	LWKAZZLXGDNWMV-UHFFFAOYSA-N
Molecular Formula	C64H20F28N8Zn
Exact Mass	1498.232 g/mol

Data and Resources

• X-ray diffraction (XRD)HTML
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• x-ray-diffraction

Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/LWKAZZLXGDNWMV-UHFFFAOYSA-N/CHMO0000156
License URL
Source	https://www.chemotion-repository.net/inchikey/LWKAZZLXGDNWMV-UHFFFAOYSA-N/CHMO0000156
Version
Author	Lukas Langer
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2025-03-08T03:01:23.380457
MetadataModified	2025-03-09T03:10:59.967625
MetadataPublished	2025-03-07
Related Molecule

Field	Value
Measurement Technique	X-ray diffraction
Measurement Variables

Data-Source Molecule ID	Data-Source
No additional information available for this Dataset.