Geometry & MOs

Info

ID:	235123
PubChem CID:	92304079
Reduced:	FSN2O2C21H23 (1)
Stoich.:	ABC2D2E21F23 (1)
Weight, g/mol:	404.137005
ΔH_f, kcal/mol:	-106.08
Dipole, Da:	4.8
IP(EA), eV:	-8.99(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations