Geometry & MOs

Info

ID:	234867
PubChem CID:	92303625
Reduced:	N2O3C25H32 (1)
Stoich.:	A2B3C25D32 (1)
Weight, g/mol:	392.119464
ΔH_f, kcal/mol:	-98.61
Dipole, Da:	5.09
IP(EA), eV:	-8.45(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[(2S)-3-(2-ethylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]furan-2-carboxamide

Drug info:

PubChemData

Smile

CCCCCCNC(=O)C[C@H](C1=C(C=C(C=C1)OC)OC)C2=CNC3=CC=CC=C32

DOS

IR

Vibrations