Geometry & MOs

Info

ID:	150009
PubChem CID:	53789693
Reduced:	N2O3C25H26 (1)
Stoich.:	A2B3C25D26 (1)
Weight, g/mol:	132.042259
ΔH_f, kcal/mol:	18.99
Dipole, Da:	1.76
IP(EA), eV:	-8.11(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-3-oxobutaneperoxoic acid

Drug info:

PubChemData

Smile

CC1=NC(=NO1)CCC#CC2=CC=CC=C2C3=CC(=C(C=C3)OC)OC4CCCC4

DOS

IR

Vibrations