For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
11H-Tribenzo[b,f,m][1,4,8,12]tetraazacyclopentadecine, 8,18-dichloro-12,13,14,15-tetrahydro-, nickel complex
SpectraBase Compound ID LhuAoUkiecJ
InChI InChI=1S/C23H18Cl2N4.Ni/c24-18-6-8-20-16(12-18)14-28-22-4-1-2-5-23(22)29-15-17-13-19(25)7-9-21(17)27-11-3-10-26-20;/h1-2,4-9,12-15H,3,10-11H2;/q-2;+2/b28-14+,29-15+;
InChIKey JYZDCVKURUXBPN-GQPTWYECSA-N
Mol Weight 480.02 g/mol
Molecular Formula C23H18Cl2N4Ni
Exact Mass 478.026194 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID LSaCQDgEeqj
Name 11H-Tribenzo[b,f,m][1,4,8,12]tetraazacyclopentadecine, 8,18-dichloro-12,13,14,15-tetrahydro-, nickel complex
CAS Registry Number 108072-88-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H18Cl2N4Ni
InChI InChI=1S/C23H18Cl2N4.Ni/c24-18-6-8-20-16(12-18)14-28-22-4-1-2-5-23(22)29-15-17-13-19(25)7-9-21(17)27-11-3-10-26-20;/h1-2,4-9,12-15H,3,10-11H2;/q-2;+2/b28-14+,29-15+;
InChIKey JYZDCVKURUXBPN-GQPTWYECSA-N
Molecular Weight 480.024 g/mol
SMILES c12[N-]=3[Ni+2]45[N-](c1cccc2)=Cc1c(N5CCCN4c2c(cc(cc2)Cl)C3)ccc(Cl)c1
SPLASH splash10-0059-0010900000-286bf002c516bddb2931
Source of Spectrum B-39-1244-9
Synonyms Nickel, [8,18-dichloro-12,13,14,15-tetrahydro-11H-tribenzo[b,f,m][1,4,8,12]tetraazacyclopentadecinato(2-)-N5,N11,N15,N21]-, (SP-4-2)- 12,24-dichloro-1,8,16,20-tetraaza-28-nickelaheptacyclo[14.11.1.0(2,7).0(8,28).0(10,15).0(20,28).0(21,26)]octacosa-1(27),2(7),3,5,8,10(15),11,13,21,23,25-undecaene-28,28-bis(ylium)-1,8-diuide 2,12-Dichloro-6,7,8,9-tetrahydro-5H-tribenzo[b,f,m][1,4,8,12]tetraazacyclopentadecinato(2-)nickel(II)
Wiley ID 1394668