Free Chemical Databases
-
[Synonyms]
[Structure]
[ Properties Computed from Structure]
Molecular Weight 562.71512 [g/mol] Molecular Formula C25H23PbS- H-Bond Donor 0 H-Bond Acceptor 1 Rotatable Bond Count 4 Exact Mass 563.128682 MonoIsotopic Mass 563.128682 Topological Polar Surface Area 0 Heavy Atom Count 27 Formal Charge -1 Complexity 318 Isotope Atom Count 0 Defined Atom StereoCenter Count 0 Undefined Atom StereoCenter Count 0 Defined Bond StereoCenter Count 0 Undefined Bond StereoCenter Count 0 Covalently-Bonded Unit Count 2
[ Descriptors Computed from Structure]
IUPAC Name: phenylmethanethiolate; tri(phenyl)plumbane
Canonical SMILES: C1=CC=C(C=C1)C[S-].C1=CC=C(C=C1)[PbH](C2=CC=CC=C2)C3=CC=CC=C3
InChI: InChI=1/C7H8S.3C6H5.Pb.H/c8-6-7-4-2-1-3-5-7;3*1-2-4-6-5-3-1;;/h1-5,8H,
6H2;3*1-5H;;/p-1/fC7H7S.3C6H5.Pb.H/h8h;;;;;/q-1;;;;;/rC18H16Pb.C7H8S/c1-
4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;8-6-7-4-2-1-3-5-7/
h1-15,19H;1-5,8H,6H2/p-1/fC18H16Pb.C7H7S/h;8h/q;-1
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