Geometry & MOs

Info

ID:	447510
PubChem CID:	135283468
Reduced:	FSN2O2C22H23 (1)
Stoich.:	ABC2D2E22F23 (1)
Weight, g/mol:	362.049191
ΔH_f, kcal/mol:	-75.22
Dipole, Da:	5.48
IP(EA), eV:	-8.86(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-chlorophenyl)sulfanyl-1-[(2-methoxyphenyl)methyl]pyrazolidine-3,5-dione

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1F)C(=O)NC2CC2)C3=CC=C(C=C3)C(=O)N4CCSCC4

DOS

IR

Vibrations