Geometry & MOs

Info

ID:	234786
PubChem CID:	92303491
Reduced:	SN2O3C23H28 (1)
Stoich.:	AB2C3D23E28 (1)
Weight, g/mol:	388.101227
ΔH_f, kcal/mol:	-94.42
Dipole, Da:	3.14
IP(EA), eV:	-8.95(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-[4-[(2R)-4-oxo-3-(4-propan-2-ylphenyl)-1,3-thiazolidin-2-yl]phenyl]acetamide

Drug info:

PubChemData

Smile

CCCCCCC(=O)NC1=CC=CC=C1[C@@H]2N(C(=O)CS2)C3=CC=CC=C3OC

DOS

IR

Vibrations