Geometry & MOs

Info

ID:	41370
PubChem CID:	8145737
Reduced:	ClOSN5C20H22 (1)
Stoich.:	ABCD5E20F22 (1)
Weight, g/mol:	350.150954
ΔH_f, kcal/mol:	62.99
Dipole, Da:	5.81
IP(EA), eV:	-8.47(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5S)-3-[[4-(3-chlorophenyl)piperazin-1-yl]methyl]-5-propylimidazolidine-2,4-dione

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)N2C=NN(C2=S)CN3CCN(CC3)C4=CC(=CC=C4)Cl

DOS

IR

Vibrations