Geometry & MOs

Info

ID:	143731
PubChem CID:	53253225
Reduced:	NSO5C24H27 (1)
Stoich.:	ABC5D24E27 (1)
Weight, g/mol:	415.108959
ΔH_f, kcal/mol:	-196.26
Dipole, Da:	2.57
IP(EA), eV:	-8.98(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1R)-2-[4-[(2,4-dioxo-1,3-thiazolidin-5-yl)methyl]phenoxy]-1-(3-methoxyphenyl)ethyl] acetate

Drug info:

PubChemData

Smile

CC(=O)O[C@H](COC1=CC=C(C=C1)CC2C(=O)NC(=O)S2)C3=CC(=CC=C3)C(C)(C)C

DOS

IR

Vibrations