CC(C)(C)P(C1=CC=C[CH-]1)C(C)(C)C.C1=CC=C(C=C1)[C-]2C(=C(C(=C2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6.[Fe+2]
Nombre: ditert-butyl(cyclopenta-1,3-dien-1-yl)phosphane;iron(2+);(2,3,4,5-tetraphenylcyclopenta-1,4-dien-1-yl)benzene
SMILES: CC(C)(C)P(C1=CC=C[CH-]1)C(C)(C)C.C1=CC=C(C=C1)[C-]2C(=C(C(=C2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6.[Fe+2]

Molecular Processing

Molecular formula
C48H47FeP
Molecular weight
710.72
Exact mass
710.2765
XLogP
13.85
TPSA
0
H-bond donors
0
H-bond acceptors
0
Rotatable bonds
6
Heavy atoms
50
Rings
7
Aromatic rings
7
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
3
Fraction Csp3
0.167
Molar refractivity
217.31

Supplementary Information

InChIKey: BOBUBHOXRCYKLI-UHFFFAOYSA-N
Sinónimos
1,2,3,4,5-Pentaphenyl-1-(di-tert-butylphosphino)ferroceneFerrocene, 1'-[bis(1,1-dimethylethyl)phosphino]-1,2,3,4,5-pentaphenyl-SCHEMBL29390453SCHEMBL30642188BOBUBHOXRCYKLI-UHFFFAOYSA-NAKOS028109616di-tert-butylphosphino pentaphenylferrocene1,2,3,4,5-pentaphenyl-1'-(di-tert-butyl-phosphino)-ferrocene1,2,3,4,5-PENTAPHENYL-1-(DI-T-BUTYLPHOSPHINO)FERROCENEferrous;ditert-butyl(cyclopenta-1,3-dien-1-yl)phosphane;(2,3,4,5-tetraphenylcyclopenta-1,4-dien-1-yl)benzene
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