2,7,12,17-tetrakis(3-bromophenyl)-21,22,23,24-tetraazapentacyclo[16.2.1.1³,?.1?,¹¹.1¹³,¹?]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaene

CAS: 68772-71-4

Formula: C44H26Br4N4

SMILES: BrC1=CC(=CC=C1)C1=C2C=CC(=N2)C(=C2NC(C=C2)=C(C2=NC(C=C2)=C(C2=CC=C1N2)C1=CC=CC(Br)=C1)C1=CC=CC(Br)=C1)C1=CC(Br)=CC=C1

IUPAC: 2,7,12,17-tetrakis(3-bromophenyl)-21,22,23,24-tetraazapentacyclo[16.2.1.1³,?.1?,¹¹.1¹³,¹?]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaene

InChI: InChI=1S/C44H26Br4N4/c45-29-9-1-5-25(21-29)41-33-13-15-35(49-33)42(26-6-2-10-30(46)22-26)37-17-19-39(51-37)44(28-8-4-12-32(48)24-28)40-20-18-38(52-40)43(36-16-14-34(41)50-36)27-7-3-11-31(47)23-27/h1-24,49,52H/b41-33-,41-34-,42-35-,42-37-,43-36-,43-38-,44-

Composition: C (56.81%), H (2.82%), Br (34.35%), N (6.02%)

Molar Mass: 930.336

Atom Count: 78

Heavy Atom Count: 52