Geometry & MOs

Info

ID:	183313
PubChem CID:	77006023
Reduced:	NO2F3C10H16 (1)
Stoich.:	AB2C3D10E16 (1)
Weight, g/mol:	353.98513
ΔH_f, kcal/mol:	-255.26
Dipole, Da:	8.32
IP(EA), eV:	-9.31(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]-5-bromo-1,3-diazinane-2,4-dione

Drug info:

PubChemData

Smile

CCCN(CC(=CC(=O)O)C)CC(F)(F)F

DOS

IR

Vibrations