Bis(1 5-cyclooctadiene)rhodium(I)

Catalog Number	ACM207124650-1
CAS	207124-65-0
Structure
Synonyms	(1Z,5Z)-Cycloocta-1,5-diene;rhodium;tetrafluoroborate;hydrate
Molecular Weight	424.1
Molecular Formula	C16H26BF4ORh
Canonical SMILES	[B-](F)(F)(F)F.C1CC=CCCC=C1.C1CC=CCCC=C1.O.[Rh]
InChI	InChI=1S/2C8H12.BF4.H2O.Rh/c2*1-2-4-6-8-7-5-3-1;2-1(3,4)5;/h2*1-2,7-8H,3-6H2;1H2;/q;-1;/b2*2-1-,8-7-;
InChI Key	RVVSQTPAHKVLPL-DIURZKMRSA-N
Melting Point	165 °C
Purity	98%+
Appearance	Powder
Complexity	91.7
Covalently-Bonded Unit Count	5
Defined Atom Stereocenter Count	0
Exact Mass	424.10678
Heavy Atom Count	23
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
Isomeric SMILES	[B-](F)(F)(F)F.C1/C=C\CC/C=C\C1.C1/C=C\CC/C=C\C1.O.[Rh]
Monoisotopic Mass	424.10678
Rotatable Bond Count	0
Topological Polar Surface Area	1 Ų