17,24-Diaza-1,9-Diazoniaheptacyclo[23.6.2.2^9,16.2^19,22.1^3,7.0^10,15.0^26,31]Octatriaconta-1(31),3(38),4,6,9,11,13,15,19,21,25,27,29,32,34,36-Hexadecaene Bis(Trifluoroacetate)
[CAS# 199934-16-2]

Identification

• Name: 17,24-Diaza-1,9-Diazoniaheptacyclo[23.6.2.2^9,16.2^19,22.1^3,7.0^10,15.0^26,31]Octatriaconta-1(31),3(38),4,6,9,11,13,15,19,21,25,27,29,32,34,36-Hexadecaene Bis(Trifluoroacetate)
• Synonyms: 6,12,19,20,25,26-Hexahydro-5,27:13,18:21,24-trietheno-11,7-metheno-7H-dibenzo [b,n] [1,5,12,16]tetraazacyclotricosine-5,13-diium dibromide; NCGC00025372-01; Tocris-1310
• Molecular Formula: C₃₈H₃₀F₆N₄O₄
• Molecular Weight: 720.66
• CAS Registry Number: 199934-16-2
• SMILES: C1C2=CC=C(CNC3=CC=[N+](CC4=CC=CC(=C4)C[N+]5=CC=C(N1)C6=CC=CC=C65)C7=CC=CC=C37)C=C2.C(=O)(C(F)(F)F)[O-].C(=O)(C(F)(F)F)[O-]
• InChI: 1S/C34H28N4.2C2HF3O2/c1-3-10-33-29(8-1)31-16-18-37(33)23-27-6-5-7-28(20-27)24-38-19-17-32(30-9-2-4-11-34(30)38)36-22-26-14-12-25(13-15-26)21-35-31;2*3-2(4,5)1(6)7/h1-20H,21-24H2;2*(H,6,7)/b35-31+,36-32+
• InChIKey: VLKOAELKWGYOFD-HZFANCAJSA-N

Properties

• Refractive index: (Cal.)