Geometry & MOs

Info

ID:	179391
PubChem CID:	76476039
Reduced:	ClNF3O3H11C14 (1)
Stoich.:	ABC3D3E11F14 (1)
Weight, g/mol:	274.116486
ΔH_f, kcal/mol:	-159.48
Dipole, Da:	5.38
IP(EA), eV:	-9.57(-2.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[5-(hydroxymethyl)-4-methylperoxyoxolan-2-yl]-5-methyl-1,3-diazinane-2,4-dione

Drug info:

PubChemData

Smile

CC(C)C1=CC2C(=NC(=C(C2=O)OC(=O)Cl)C(F)(F)F)C=C1

DOS

IR

Vibrations