Geometry & MOs

Info

ID:	149380
PubChem CID:	53789052
Reduced:	NP2O6C46H61 (1)
Stoich.:	AB2C6D46E61 (1)
Weight, g/mol:	206.079038
ΔH_f, kcal/mol:	-249.92
Dipole, Da:	3.21
IP(EA), eV:	-8.58(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(2-methylpropan-2-yl)oxyperoxy]-4-oxobutanoic acid

Drug info:

PubChemData

Smile

CCCCOC(=O)N1CC(CC1CP(C2=CC(=C(C(=C2)C)OC)C)C3=CC(=C(C(=C3)C)OC)C)P(C4=CC(=C(C(=C4)C)OC)C)C5=CC(=C(C(=C5)C)OC)C

DOS

IR

Vibrations