Chemical Properties of Iron, (1,3-butadiene)tricarbonyl- (CAS 12078-32-9)

InChI

InChI=1S/C4H6.3CO.Fe/c1-3-4-2;3*1-2;/h3-4H,1-2H2;;;;

InChI Key

NBFCJULAAWWTBL-UHFFFAOYSA-N

Formula

C7H6FeO3

SMILES

C=CC=C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

Molecular Weight¹

193.97

CAS

12078-32-9

Other Names

Iron, («eta»4-1,3-butadiene)tricarbonyl-
(1,3-Butadiene)tricarbonyl iron
Butadiene iron tricarbonyl
Butadiene tricarbonyl iron
Tricarbonyl(1,3-butadiene)iron
Tricarbonylbutadiene iron
(CH2=CHCH=CH2)(CO)3Fe
1,3-Butadiene iron tricarbonyl
(«eta»4-1,3-Butadiene)tricarbonyliron
NSC 58462
(«eta»-1,3-butadiene)tricarbonyliron

EA : Electron affinity (eV).
Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
Δ_fH°_liquid : Liquid phase enthalpy of formation at standard conditions (kJ/mol).
Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
IE : Ionization energy (eV).
¹: Molecular weight from the IUPAC atomic weights tables.

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Physical Properties

Property	Value	Unit	Source
EA	0.90	eV	NIST
Δ_fH°_gas	-358.80 ± 7.10	kJ/mol	NIST
Δ_fH°_liquid	-407.80 ± 5.70	kJ/mol	NIST
Δ_vapH°	49.00 ± 4.20	kJ/mol	NIST
IE	[8.00; 8.23]	eV
IE	8.00	eV	NIST
IE	8.04	eV	NIST
IE	8.16	eV	NIST
IE	8.22	eV	NIST
IE	8.16	eV	NIST
IE	8.23	eV	NIST

Similar Compounds

Find more compounds similar to Iron, (1,3-butadiene)tricarbonyl-.

Sources

NIST Webbook

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