Molecule:100880

‎

Properties
CID	n/a
CAS	n/a
IUPAC-Name	n/a
Abbreviation	n/a
Trivialname	n/a
Exact mass	3150.404894826
Molecular formula	C132H108F18N6O12P9Re3
LogP	n/a
Has vendors	n/a
Molecular role	n/a
Synonyms	n/a

100880

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InChI	InChI=1S/3C30H24P2.3C12H12N2O2.6CO.3F6P.3Re/c3*1-5-13-25(14-6-1)31(26-15-7-2-8-16-26)29-21-23-30(24-22-29)32(27-17-9-3-10-18-27)28-19-11-4-12-20-28;3*1-15-9-3-5-11(13-7-9)12-6-4-10(16-2)8-14-12;6*1-2;3*1-7(2,3,4,5)6;;;/h3*1-24H;3*3-8H,1-2H3;;;;;;;;;;;;/q;;;;;;;;;;;;6*-1/p+6
InChI-Key	VAJKGYDPDYOVPF-UHFFFAOYSA-T
SMILES	COc1ccc2n(~[Re+]3(~[C-]#[O+])(~[C-]#[O+])(~P(c4ccccc4)(c4ccccc4)c4ccc(cc4)P(c4ccccc4)(c4ccccc4)~[Re+]4(~[C-]#[O+])(~[C-]#[O+])(~P(c5ccccc5)(c5ccccc5)c5ccc(cc5)P(c5ccccc5)(c5ccccc5)~[Re+]5(~[C-]#[O+])(~[C-]#[O+])(~P(c6ccccc6)(c6ccccc6)c6ccc(cc6)P~3(c3ccccc3)c3ccccc3)~n3cc(OC)ccc3-c3ccc(OC)cn~53)~n3cc(OC)ccc3-c3ccc(OC)cn~43)~n3cc(OC)ccc3-2)c1.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F

Belongs to molecule collection: Molecule collection 100730 ‎