p-tert-Butylcalix[4]arene-tert-butylimidomolybdenum(VI)

SpectraBase Compound ID	x76j6KIlXu
InChI	InChI=1S/C44H56O4.C4H9N.Mo/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;1-4(2,3)5;/h17-24,45-48H,13-16H2,1-12H3;1-3H3;/q;-2;+4/p-4
InChIKey	UCHPSNUCMYVZHK-UHFFFAOYSA-J Google Search
Mol Weight	811.97 g/mol
Molecular Formula	C48H61MoNO4
Exact Mass	813.365463 g/mol

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SpectraBase Spectrum ID	1nqzCrNVoG
Name	p-tert-Butylcalix[4]arene-tert-butylimidomolybdenum(VI)
Alternate Name(s)	molybdenum(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) tert-butylnitride
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C48H61MoNO4
InChI	InChI=1S/C44H56O4.C4H9N.Mo/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;1-4(2,3)5;/h17-24,45-48H,13-16H2,1-12H3;1-3H3;/q;-2;+4/p-4
InChIKey	UCHPSNUCMYVZHK-UHFFFAOYSA-J
Molecular Weight	811.970 g/mol
SMILES	C([N-2])(C)(C)C.c12c(c(cc(c2)C(C)(C)C)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)[O-].[Mo+4]
SPLASH	splash10-06r6-9000000450-e8cb53f2a6e8657d0ba0
Source of Spectrum	U2-1999-2228-1a
Wiley ID	1790757