p-tert-Butylcalix[4]arenemesitylimidotungsten(VI)

SpectraBase Compound ID	BGurmdbS2mC
InChI	InChI=1S/C44H56O4.C9H11N.W/c1-41(2,3)33-17-25-13-27-19-34(42(4,5)6)21-29(38(27)46)15-31-23-36(44(10,11)12)24-32(40(31)48)16-30-22-35(43(7,8)9)20-28(39(30)47)14-26(18-33)37(25)45;1-6-4-7(2)9(10)8(3)5-6;/h17-24,45-48H,13-16H2,1-12H3;4-5H,1-3H3;/q;-2;+4/p-4
InChIKey	VEOLTFDVSVPMCK-UHFFFAOYSA-J Google Search
Mol Weight	961.9 g/mol
Molecular Formula	C53H63NO4W
Exact Mass	961.426643 g/mol

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SpectraBase Spectrum ID	102tP8OQzHv
Name	p-tert-Butylcalix[4]arenemesitylimidotungsten(VI)
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C53H63NO4W
InChI	InChI=1S/C44H56O4.C9H11N.W/c1-41(2,3)33-17-25-13-27-19-34(42(4,5)6)21-29(38(27)46)15-31-23-36(44(10,11)12)24-32(40(31)48)16-30-22-35(43(7,8)9)20-28(39(30)47)14-26(18-33)37(25)45;1-6-4-7(2)9(10)8(3)5-6;/h17-24,45-48H,13-16H2,1-12H3;4-5H,1-3H3;/q;-2;+4/p-4
InChIKey	VEOLTFDVSVPMCK-UHFFFAOYSA-J
Molecular Weight	961.931 g/mol
SMILES	[W+4].c1c(C)c(c(C)cc1C)[N-2].c12cc(C(C)(C)C)cc(c2[O-])Cc2c([O-])c(Cc3c(c(Cc4cc(cc(C1)c4[O-])C(C)(C)C)cc(C(C)(C)C)c3)[O-])cc(C(C)(C)C)c2
SPLASH	splash10-03di-0000200009-3bfdcd44c8de4415c265
Source of Spectrum	U2-1999-2229-2b
Synonyms	tungsten(VI) 1(5),3(5),5(5),7(5)-tetra-tert-butyl-1,3,5,7(1,3)-tetrabenzenacyclooctaphane-1(2),3(2),5(2),7(2)-tetrakis(olate) mesitylnitride
Wiley ID	1790759