Geometry & MOs

Info

ID:	34429
PubChem CID:	7975554
Reduced:	FSO2N3C20H20 (1)
Stoich.:	ABC2D3E20F20 (1)
Weight, g/mol:	395.184506
ΔH_f, kcal/mol:	-4.98
Dipole, Da:	3.11
IP(EA), eV:	-8.22(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[2,5-dimethyl-1-(2-phenylethyl)pyrrol-3-yl]-2-oxoethyl]-3-propan-2-ylimidazolidine-2,4,5-trione

Drug info:

PubChemData

Smile

COCCN=C1N(C(=CS1)C2=CC=CC=C2F)/N=C\C3=CC=C(C=C3)OC

DOS

IR

Vibrations