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1803-18-5 | Carbamodithioic acid, N,N-diethyl-, triphenylstannyl ester
CAS No: 1803-18-5 Catalog No: AG0021W9 MDL No:
Product Description
Catalog Number:
AG0021W9
Chemical Name:
Carbamodithioic acid, N,N-diethyl-, triphenylstannyl ester
CAS Number:
1803-18-5
Molecular Formula:
C23H25NS2Sn
Molecular Weight:
498.2823
IUPAC Name:
triphenylstannyl N,N-diethylcarbamodithioate
InChI:
InChI=1S/3C6H5.C5H11NS2.Sn/c3*1-2-4-6-5-3-1;1-3-6(4-2)5(7)8;/h3*1-5H;3-4H2,1-2H3,(H,7,8);/q;;;;+1/p-1
InChI Key:
DVZANXQULQQLLV-UHFFFAOYSA-M
SMILES:
CCN(C(=S)S[Sn](c1ccccc1)(c1ccccc1)c1ccccc1)CC
NSC Number:
118039
Properties
Complexity:
402
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
499.045g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
498.29g/mol
Monoisotopic Mass:
499.045g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
60.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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