Geometry & MOs

Info

ID:	143721
PubChem CID:	53253090
Reduced:	SN2O5H24C26 (1)
Stoich.:	AB2C5D24E26 (1)
Weight, g/mol:	484.209718
ΔH_f, kcal/mol:	-138.9
Dipole, Da:	4.84
IP(EA), eV:	-8.97(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzoyl 2-[(2-methylpropan-2-yl)oxycarbonyloxy]-5-octanoylbenzenecarboperoxoate

Drug info:

PubChemData

Smile

CCC1=NC=C(C=C1)C(COC2=CC=C(C=C2)CC3C(=O)NC(=O)S3)OC(=O)C4=CC=CC=C4

DOS

IR

Vibrations