Geometry & MOs

Info

ID:	156770
PubChem CID:	56385551
Reduced:	O2S2N3C18H21 (1)
Stoich.:	A2B2C3D18E21 (1)
Weight, g/mol:	456.069984
ΔH_f, kcal/mol:	13.35
Dipole, Da:	5.41
IP(EA), eV:	-8.49(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl]-5-methyl-5-[4-(trifluoromethoxy)phenyl]imidazolidine-2,4-dione

Drug info:

PubChemData

Smile

COC1=CC=CC=C1N2C(=NN=C2SCCCCCO)C3=CC=CS3

DOS

IR

Vibrations