3,3',3'',3'''-Germanetetrayltetrakis(triaza-1,2-dien-2-ium-1-ide)

CAS Number: 57980-16-2
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[N-]=[N+]=N[Ge](N=[N+]=[N-])(N=[N+]=[N-])N=[N+]=[N-]
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
N12Ge
Molecular Weight
240.694
Drug-likeness
-3.145
CAS
57980-16-2
InChI key
YBYAYCCHMCBTTM-UHFFFAOYSA-N
SMILES
[N-]=[N+]=N[Ge](N=[N+]=[N-])(N=[N+]=[N-])N=[N+]=[N-]
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 57980-16-2
Molecule Name 3,3',3'',3'''-Germanetetrayltetrakis(triaza-1,2-dien-2-ium-1-ide)
Molecular Formula N12Ge
SMILES [N-]=[N+]=N[Ge](N=[N+]=[N-])(N=[N+]=[N-])N=[N+]=[N-]
InChI InChI=1S/GeN12/c2-10-6-1(7-11-3,8-12-4)9-13-5
InChI Key YBYAYCCHMCBTTM-UHFFFAOYSA-N
CanonicalSyTyLFy 5b11da6006f6924d
TotalMolweight 240.694
Molecular Weight 240.694
MonoisotopicMass 241.958065
CLogS -0.53
H Acceptors 12
TotalSurfaceArea 149.56
Relative PSA 1
PolarSurfaceArea 103.84
Drug-likeness -3.145
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Nasty Functions unwanted atom
Shape Index 0.53846
Molecula Flexibility 0.77353
Molecular Complexity 0.3662
Fragments 1
Non HAtoms 13
NonCHAtoms 13
Electronegative Atoms 12
Rotatable Bond 4
Symmetricatoms 9

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