Dataset

infrared absorption spectroscopy (IR)

dataset for infrared absorption spectroscopy (IR)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C40H32N2P.BrH/c1-30-40(29-43(33-21-11-4-12-22-33,34-23-13-5-14-24-34)35-25-15-6-16-26-35)42-39-28-37(32-19-9-3-10-20-32)36(27-38(39)41-30)31-17-7-2-8-18-31;/h2-28H,29H2,1H3;1H/q+1;/p-1
SMILES Cc1nc2cc(c3ccccc3)c(cc2nc1C[P+](c1ccccc1)(c1ccccc1)c1ccccc1)c1ccccc1.[Br-]
InChI Key RPLOTKMXWPILHZ-UHFFFAOYSA-M
Molecular Formula C40H32BrN2P
Exact Mass 651.573 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/RPLOTKMXWPILHZ-UHFFFAOYSA-M/CHMO0000630
License URL
Source https://www.chemotion-repository.net/inchikey/RPLOTKMXWPILHZ-UHFFFAOYSA-M/CHMO0000630
Version
Author Jérôme Klein
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T06:38:55.027093
MetadataModified 2024-09-07T22:14:08.836058
MetadataPublished 2022-04-17
Field Value
Measurement Technique infrared absorption spectroscopy
Measurement Variables