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85183-87-5 | OXO[5,10,15,20-TETRA(4-PYRIDYL)PORPHINATO]TITANIUM(IV)
CAS No: 85183-87-5 Catalog No: AG00G7BI MDL No:
Product Description
Catalog Number:
AG00G7BI
Chemical Name:
OXO[5,10,15,20-TETRA(4-PYRIDYL)PORPHINATO]TITANIUM(IV)
CAS Number:
85183-87-5
IUPAC Name:
oxotitanium(2+);5,10,15,20-tetrapyridin-4-ylporphyrin-22,24-diide
InChI:
InChI=1S/C40H24N8.O.Ti/c1-2-30-38(26-11-19-42-20-12-26)32-5-6-34(47-32)40(28-15-23-44-24-16-28)36-8-7-35(48-36)39(27-13-21-43-22-14-27)33-4-3-31(46-33)37(29(1)45-30)25-9-17-41-18-10-25;;/h1-24H;;/q-2;;+2
InChI Key:
GNZXTMFGHRXKDZ-UHFFFAOYSA-N
Properties
Complexity:
1370
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
680.155g/mol
Formal Charge:
0
Heavy Atom Count:
50
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
680.554g/mol
Monoisotopic Mass:
680.155g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
95.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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