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Home > Other Heterocycles > 100432-50-6
100432-50-6 | Bicyclo[3.1.1]heptane-2-thiol, 2,6,6-trimethyl-, rhodium(3+) salt (3:1)
CAS No: 100432-50-6 Catalog No: AG0001ZL MDL No:
Product Description
Catalog Number:
AG0001ZL
Chemical Name:
Bicyclo[3.1.1]heptane-2-thiol, 2,6,6-trimethyl-, rhodium(3+) salt (3:1)
CAS Number:
100432-50-6
Molecular Formula:
C30H51RhS3
Molecular Weight:
610.8264
IUPAC Name:
rhodium(3+);2,6,6-trimethylbicyclo[3.1.1]heptane-2-thiolate
InChI:
InChI=1S/3C10H18S.Rh/c3*1-9(2)7-4-5-10(3,11)8(9)6-7;/h3*7-8,11H,4-6H2,1-3H3;/q;;;+3/p-3
InChI Key:
IBCXUHINDDQPEW-UHFFFAOYSA-K
SMILES:
[S-]C1(C)CCC2CC1C2(C)C.[S-]C1(C)CCC2CC1C2(C)C.[S-]C1(C)CCC2CC1C2(C)C.[Rh+3]
EC Number:
309-624-0
Properties
Complexity:
185
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
4
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
610.221g/mol
Formal Charge:
0
Heavy Atom Count:
34
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
610.823g/mol
Monoisotopic Mass:
610.221g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
3A^2
Undefined Atom Stereocenter Count:
9
Undefined Bond Stereocenter Count:
0
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