biostudies-literature00400Unknown66(Pt 12)Shah RDThe 12 non-H atoms defining the triple-fused-ring system in the title compound, C(19)H(13)ClN(6), are almost coplanar (r.m.s. deviation = 0.023?Å). The chloro-substituted ring is almost effectively coplanar with the central atoms [dihedral angle = 6.74?(13)°], but the N-bound benzene ring is not [dihedral angle = 54.38?(13)°]. In the crystal, supra-molecular chains along the a axis sustained by C-H?? and ?-? [centroid-centroid distance between N(4)C and C(4)N five-membered rings = 3.484?(2)?Å] stacking occur. A very long C-Cl?? contact is also seen.Acta crystallographica. Section E, Structure reports onlineo3305https://www.ebi.ac.uk/biostudies/studies/S-EPMC3011633biostudies-literature12-(4-Chloro-phen-yl)-7-methyl-10-phenyl-3,4,5,6,8,10-hexa-aza-tricyclo-[7.3.0.0]dodeca-1(9),2,4,7,11-penta-ene.PMC3011633Jotani MMShah RDTiekink ER40false12-(4-Chloro-phen-yl)-7-methyl-10-phenyl-3,4,5,6,8,10-hexa-aza-tricyclo-[7.3.0.0]dodeca-1(9),2,4,7,11-penta-ene.The 12 non-H atoms defining the triple-fused-ring system in the title compound, C(19)H(13)ClN(6), are almost coplanar (r.m.s. deviation = 0.023?Å). The chloro-substituted ring is almost effectively coplanar with the central atoms [dihedral angle = 6.74?(13)°], but the N-bound benzene ring is not [dihedral angle = 54.38?(13)°]. In the crystal, supra-molecular chains along the a axis sustained by C-H?? and ?-? [centroid-centroid distance between N(4)C and C(4)N five-membered rings = 3.484?(2)?Å] stacking occur. A very long C-Cl?? contact is also seen.2010-01-01T00:00:00Z2010 Nov2021-02-28T08:30:46Z2019-03-27T00:01:02ZS-EPMC30116332158958310.1107/S1600536810048373