Geometry & MOs

Info

ID:	60096
PubChem CID:	26675680
Reduced:	N4O5H20C21 (1)
Stoich.:	A4B5C20D21 (1)
Weight, g/mol:	440.151826
ΔH_f, kcal/mol:	-76.76
Dipole, Da:	4.59
IP(EA), eV:	-8.57(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5S)-5-ethyl-3-[2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]-5-phenylimidazolidine-2,4-dione

Drug info:

PubChemData

Smile

C[C@]1(C(=O)N(C(=O)N1)CC2=NC(=NO2)C3=CC(=C(C=C3)OC)OC)C4=CC=CC=C4

DOS

IR

Vibrations