CAS 601494-52-4 ATBTA-Eu3+, 90% - Materials / Alfa Chemistry

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ATBTA-Eu3+, 90%

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Catalog Number

ACM601494524

Product Name

ATBTA-Eu3+, 90%

Structure

CAS

601494-52-4

Category

Other Glass and Ceramic Materials

IUPAC Name

sodium;2-[[6-[4-[4-(4-aminophenyl)phenyl]-6-[6-[[bis(carboxylatomethyl)amino]methyl]pyridin-2-yl]pyridin-2-yl]pyridin-2-yl]methyl-(carboxylatomethyl)amino]acetate;europium(3+)

Molecular Weight

861.6g/mol

Molecular Formula

C37H30EuN6NaO8

Canonical SMILES

C1=CC(=NC(=C1)C2=CC(=CC(=N2)C3=CC=CC(=N3)CN(CC(=O)[O-])CC(=O)[O-])C4=CC=C(C=C4)C5=CC=C(C=C5)N)CN(CC(=O)[O-])CC(=O)[O-].[Na+].[Eu+3]

InChI

InChI=1S/C37H34N6O8.Eu.Na/c38-27-13-11-24(12-14-27)23-7-9-25(10-8-23)26-15-32(30-5-1-3-28(39-30)17-42(19-34(44)45)20-35(46)47)41-33(16-26)31-6-2-4-29(40-31)18-43(21-36(48)49)22-37(50)51;;/h1-16H,17-22,38H2,(H,44,45)(H,46,47)(H,48,49)(H,50,51);;/q;+3;+1/p-4

InChI Key

WPJHPWPASHGOEZ-UHFFFAOYSA-J

Complexity

1040

Covalently-Bonded Unit Count

Exact Mass

862.12352g/mol

Formal Charge

Heavy Atom Count

Monoisotopic Mass

862.12352g/mol

Rotatable Bond Count