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Platinum, [μ-[N,N'-bis[3-(amino-κN)propyl]-1,4-butanediamine-κN:κN']]bis[propanedioato(2-)-κO1,κO3]di-

Catalog Number ACM187224642
CAS 187224-64-2
Synonyms N,N'-Bis(3-aminopropyl)butane-1,4-diamine;platinum(2+);propanedioate
Molecular Weight 796.59
Molecular Formula C16H30N4O8Pt2
Canonical SMILES C(CCNCCCN)CNCCCN.C(C(=O)[O-])C(=O)[O-].C(C(=O)[O-])C(=O)[O-].[Pt+2].[Pt+2]
InChI InChI=1S/C10H26N4.2C3H4O4.2Pt/c11-5-3-9-13-7-1-2-8-14-10-4-6-12;2*4-2(5)1-3(6)7;/h13-14H,1-12H2;2*1H2,(H,4,5)(H,6,7);/q;2*+2/p-4
InChI Key LLUAUFVLLXPPBZ-UHFFFAOYSA-J
Purity 98%
Complexity 158
Covalently-Bonded Unit Count 5
Defined Atom Stereocenter Count 0
Exact Mass 795.133842
Heavy Atom Count 30
Hydrogen Bond Acceptor Count 12
Hydrogen Bond Donor Count 4
Monoisotopic Mass 796.13595
Rotatable Bond Count 11
Topological Polar Surface Area 237 Ų

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