Home Other Building Blocks 5,10,15,20-Tetrakis(pentafluorophenyl)-21h,23h-porphine palladium(ii)

5,10,15,20-Tetrakis(pentafluorophenyl)-21h,23h-porphine palladium(ii)

CAS No.:
72076-09-6
Catalog Number:
AG00FAJV
Molecular Formula:
C44H8F20N4Pd
Molecular Weight:
1078.9492
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Product Description
Catalog Number:
AG00FAJV
Chemical Name:
5,10,15,20-Tetrakis(pentafluorophenyl)-21h,23h-porphine palladium(ii)
CAS Number:
72076-09-6
Molecular Formula:
C44H8F20N4Pd
Molecular Weight:
1078.9492
MDL Number:
MFCD01320999
IUPAC Name:
palladium(2+);5,10,15,20-tetrakis(2,3,4,5,6-pentafluorophenyl)porphyrin-22,24-diide
InChI:
InChI=1S/C44H8F20N4.Pd/c45-25-21(26(46)34(54)41(61)33(25)53)17-9-1-2-10(65-9)18(22-27(47)35(55)42(62)36(56)28(22)48)12-5-6-14(67-12)20(24-31(51)39(59)44(64)40(60)32(24)52)16-8-7-15(68-16)19(13-4-3-11(17)66-13)23-29(49)37(57)43(63)38(58)30(23)50;/h1-8H;/q-2;+2
InChI Key:
GRRRJZUTYPIXFO-UHFFFAOYSA-N
SMILES:
Fc1c(F)c(/C/2=C/3\C=CC(=N3)/C(=c/3\n4[Pd]n5c2ccc5/C(=C\2/C=CC(=N2)/C(=c\4/cc3)/c2c(F)c(F)c(c(c2F)F)F)/c2c(F)c(F)c(c(c2F)F)F)/c2c(F)c(F)c(c(c2F)F)F)c(c(c1F)F)F
Properties
Complexity:
1390  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
1077.946g/mol
Formal Charge:
0
Heavy Atom Count:
69  
Hydrogen Bond Acceptor Count:
24  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
1078.964g/mol
Monoisotopic Mass:
1077.946g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
27.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties