Geometry & MOs

Info

ID:	180248
PubChem CID:	76604117
Reduced:	FO2N5C16H20 (1)
Stoich.:	AB2C5D16E20 (1)
Weight, g/mol:	453.12325
ΔH_f, kcal/mol:	-65.5
Dipole, Da:	4.12
IP(EA), eV:	-9.41(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[3-(4-fluorophenyl)propyl]-4-(2-hydroxy-4-methoxyphenyl)-3-phenyl-1,3-thiazolidine-2-thione

Drug info:

PubChemData

Smile

CNC(=O)C(C(CN)C1=CC=CC=C1)NC(=O)C2=CN(N=C2F)C

DOS

IR

Vibrations