0XM

1,1-diphenylmethanamine

Created:	2012-08-29
Last modified:	2024-09-27

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2 entries where 0XM is found as a standalone ligand1 entries where 0XM is found in a polymer sequence

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Chemical Details
Formal Charge	0
Atom Count	27
Chiral Atom Count	0
Bond Count	28
Aromatic Bond Count	12

2D diagram of 0XM

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Chemical Component Summary
Name	1,1-diphenylmethanamine
Systematic Name (OpenEye OEToolkits)	diphenylmethanamine
Formula	C₁₃ H₁₃ N
Molecular Weight	183.249
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	c1(ccccc1)C(N)c2ccccc2
SMILES	CACTVS	3.370	NC(c1ccccc1)c2ccccc2
SMILES	OpenEye OEToolkits	1.7.6	c1ccc(cc1)C(c2ccccc2)N
Canonical SMILES	CACTVS	3.370	NC(c1ccccc1)c2ccccc2
Canonical SMILES	OpenEye OEToolkits	1.7.6	c1ccc(cc1)C(c2ccccc2)N
InChI	InChI	1.03	InChI=1S/C13H13N/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,13H,14H2
InChIKey	InChI	1.03	MGHPNCMVUAKAIE-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	7036
ChEMBL	CHEMBL467503
CCDC/CSD	HALMEM01, YARBEZ, HALMEM, ZOHPUH, ZOHRIX, SOVZEJ, ESIMUQ, ESIMIE, ESIMEA

RCSB PDB Core Operations are funded by the U.S. National Science Foundation (DBI-2321666), the US Department of Energy (DE-SC0019749), and the National Cancer Institute, National Institute of Allergy and Infectious Diseases, and National Institute of General Medical Sciences of the National Institutes of Health under grant R01GM157729.