Base information

Cat. No.
CAS No.155773-70-9
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C80H88N8NiO8
Molecular Weight 1348.3
Exact Mass 1346.61
XLogP3 15.5084
Mr 412.62
PSA 157.86
Sequence -
Atom number 185
Bond number 198
Ring number 14
Rotor number 32
Residues number 0
Canonical smiles CCCCOc1c2C3=N/C(=N\c4c5c(OCCCC)c6ccccc6c(c5c5n4[Ni]n4/c(=N\3)/c3c(OCCCC)c6ccccc6c(c3/c/4=N/C3=N/C(=N\5)/c4c3c(OCCCC)c3c(c4OCCCC)cccc3)OCCCC)OCCCC)/c2c(c2c1cccc2)OCCCC

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