Geometry & MOs

Info

ID:	389617
PubChem CID:	134994083
Reduced:	FeNO6H9C10 (1)
Stoich.:	ABC6D9E10 (1)
Weight, g/mol:	270.105467
ΔH_f, kcal/mol:	-21.05
Dipole, Da:	4.49
IP(EA), eV:	-7.45(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[butoxy(methylsulfinylmethyl)phosphoryl]oxybutane

Drug info:

PubChemData

Smile

COC(=O)N(C[CH]C=C)[C-]=O.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

DOS

IR

Vibrations