Geometry & MOs

Info

ID:	46501
PubChem CID:	10524807
Reduced:	OPH25C27 (1)
Stoich.:	ABC25D27 (1)
Weight, g/mol:	396.125612
ΔH_f, kcal/mol:	19.65
Dipole, Da:	4.56
IP(EA), eV:	-8.87(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3-hydroxyphenyl)-5-methyl-4-oxo-1,3-thiazolidin-3-yl]-2-(2-methylbenzimidazol-1-yl)acetamide

Drug info:

PubChemData

Smile

C[C@@]12CP(=O)(C(=C1C3=CC=CC=C3)C4=CC=CC=C4)[C@@](C2=C)(C)C5=CC=CC=C5

DOS

IR

Vibrations