AU8

[3,5-bis(chloranyl)-4-phenyl-phenyl]methylazanium

Created:	2017-08-22
Last modified:	2018-02-28

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1 entries where AU8 is found as a standalone ligand

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Chemical Details
Formal Charge	1
Atom Count	28
Chiral Atom Count	0
Bond Count	29
Aromatic Bond Count	12

2D diagram of AU8

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Chemical Component Summary
Name	[3,5-bis(chloranyl)-4-phenyl-phenyl]methylazanium
Systematic Name (OpenEye OEToolkits)	[3,5-bis(chloranyl)-4-phenyl-phenyl]methylazanium
Formula	C₁₃ H₁₂ Cl₂ N
Molecular Weight	253.147
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	[NH3+]Cc1cc(Cl)c(c(Cl)c1)c2ccccc2
SMILES	OpenEye OEToolkits	2.0.6	c1ccc(cc1)c2c(cc(cc2Cl)C[NH3+])Cl
Canonical SMILES	CACTVS	3.385	[NH3+]Cc1cc(Cl)c(c(Cl)c1)c2ccccc2
Canonical SMILES	OpenEye OEToolkits	2.0.6	c1ccc(cc1)c2c(cc(cc2Cl)C[NH3+])Cl
InChI	InChI	1.03	InChI=1S/C13H11Cl2N/c14-11-6-9(8-16)7-12(15)13(11)10-4-2-1-3-5-10/h1-7H,8,16H2/p+1
InChIKey	InChI	1.03	CVRVMSHFNIYTSS-UHFFFAOYSA-O

Related Resource References

Resource Name	Reference
PubChem	137348948

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