1-Butanaminium, N,N,N-tributyl-, (SP-4-1)-bis[3,6-dichloro-1,2-benzenedithiolato(2-)-κS1,κS2]nickelate(1-) (1:1)
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![1-Butanaminium, N,N,N-tributyl-, (SP-4-1)-bis[3,6-dichloro-1,2-benzenedithiolato(2-)-κS1,κS2]nickelate(1-) (1:1) structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/91693616e5554525872bf15254f13e66.png "1-Butanaminium, N,N,N-tributyl-, (SP-4-1)-bis[3,6-dichloro-1,2-benzenedithiolato(2-)-κS1,κS2]nickelate(1-) (1:1)")
1-Butanaminium, N,N,N-tributyl-, (SP-4-1)-bis[3,6-dichloro-1,2-benzenedithiolato(2-)-κS1,κS2]nickelate(1-) (1:1)
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CAS No:
87314-14-5
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Formula:
C16H36N.C12H4Cl4NiS4
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Chemical Name:
1-Butanaminium, N,N,N-tributyl-, (SP-4-1)-bis[3,6-dichloro-1,2-benzenedithiolato(2-)-κS1,κS2]nickelate(1-) (1:1)
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Synonyms:
1-Butanaminium,N,N,N-tributyl-,(SP-4-1)-bis[3,6-dichloro-1,2-benzenedithiolato(2-)-κS1,κS2]nickelate(1-) (1:1);1-Butanaminium,N,N,N-tributyl-,(SP-4-1)-bis[3,6-dichloro-1,2-benzenedithiolato(2-)-S,S′]nickelate(1-);1-Butanaminium,N,N,N-tributyl-,(SP-4-1)-bis[3,6-dichloro-1,2-benzenedithiolato(2-)-κS,κS′]nickelate(1-);Nickelate(1-),(SP-4-1)-bis[3,6-dichloro-1,2-benzenedithiolato(2-)-S,S′]-,N,N,N-tributyl-1-butanaminium;1,2-Benzenedithiol,3,6-dichloro-,nickel complex;ADS 845MC;T 3204
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CAS No:
1-Butanaminium, N,N,N-tributyl-, (SP-4-1)-bis[3,6-dichloro-1,2-benzenedithiolato(2-)-κS1,κS2]nickelate(1-) (1:1) Basic Attributes
723.4
718.012162
Safety Information
3
20/21/22-36/37/38
26-36
Xn
|Danger|H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]|P201, P202, P260, P261, P264, P270, P272, P280, P281, P285, P302+P352, P304+P341, P308+P313, P314, P321, P333+P313, P342+P311, P363, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:719.4
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:12
Exact Mass:718.012162
Monoisotopic Mass:716.015112
Topological Polar Surface Area:4
Heavy Atom Count:38
Complexity:363
Covalently-Bonded Unit Count:4
Compound Is Canonicalized:Yes
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