AC1L4KO9 structure

AC1L4KO9

azane;chromium(3+);17,18-dimethoxy-5,7-dioxa-13-azoniapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-1(21),2,4(8),9,13,15,17,19-octaene;tetrathiocyanate

Also Known As: Benzo(g)-1,3-benzodioxolo(5,6-a)quinolizinium, 5,6-dihydro-9,10-dimethoxy-, (OC-6-11)-diamminetetrakis(thiocyanato-N)chromate(1-)|Chromium(3+) 10,11-dimethoxy-5,6-dihydro-2H-[1,3]dioxolo[4,5-g]isoquinolino[3,2-a]isoquinolin-7-ium thiocyanate--ammonia (1/1/4/2)

CAS: 85537-01-5
Molecular Formula C24H24CrN7O4S4
Molecular Weight 654.01776 g/mol
LogP 3.47532
Topological Polar Surface Area 142.0 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 14
Rotatable Bonds 2
Exact Mass 654.01776
Monoisotopic Mass 654.01776
Heavy Atoms 40
Complexity 520.0

Chemical Identifiers

CAS Number 85537-01-5
SMILES COC1=C(C=C2C=[N+]3CCC4=CC5=C(C=C4C3=CC2=C1)OCO5)OC.C(#N)[S-].C(#N)[S-].C(#N)[S-].C(#N)[S-].N.N.[Cr+3]
InChIKey REJPQAIQCLNTMK-UHFFFAOYSA-J

Product Overview

AC1L4KO9 (CAS 85537-01-5), with molecular formula C24H24CrN7O4S4 and molecular weight 654.01776 g/mol. IUPAC: azane;chromium(3+);17,18-dimethoxy-5,7-dioxa-13-azoniapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-1(21),2,4(8),9,13,15,17,19-octaene;tetrathiocyanate.

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