Geometry & MOs

Info

ID:	235121
PubChem CID:	92304075
Reduced:	SN2O2C19H20 (1)
Stoich.:	AB2C2D19E20 (1)
Weight, g/mol:	386.146427
ΔH_f, kcal/mol:	-52.66
Dipole, Da:	6.17
IP(EA), eV:	-8.77(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[(2R)-3-(3-fluorophenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]hexanamide

Drug info:

PubChemData

Smile

CCC(=O)NC1=CC=CC(=C1)[C@H]2N(C(=O)CS2)C3=CC=CC(=C3)C

DOS

IR

Vibrations