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1,5,7,11-tetraaza-6-cupraspiro[5.5]undecane-6,6-bis(ylium) chloride

1,5,7,11-tetraaza-6-cupraspiro[5.5]undecane-6,6-bis(ylium) chloride

CAS: 32270-93-2

Formula: C6H16ClCuN4

SMILES: [Cl-].C1CN[Cu++]2(NC1)NCCCN2

IUPAC: 1,5,7,11-tetraaza-6-cupraspiro[5.5]undecane-6,6-bis(ylium) chloride

InChI: InChI=1S/2C3H8N2.ClH.Cu/c2*4-2-1-3-5;;/h2*4-5H,1-3H2;1H;/q2*-2;;+6/p-1

Composition: C (29.63%), H (6.63%), Cl (14.58%), Cu (26.13%), N (23.04%)

Molar Mass: 243.22

Atom Count: 28

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 242.035399
Formal Charge 1
FSP3 1
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 4
InChIKey XMMWXEOJHWJEIG-UHFFFAOYSA-M
Lipinski's Rule of Five 1
Molar Refractivity 84.24
Topological Polar Surface Area 48.12
Polarizability 20.39
Ring Count 2
Rotatable Bond Count 0

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