Geometry & MOs

Info

ID:	405742
PubChem CID:	135075287
Reduced:	BN2S2C17H19 (1)
Stoich.:	AB2C2D17E19 (1)
Weight, g/mol:	307.018225
ΔH_f, kcal/mol:	33.81
Dipole, Da:	7.29
IP(EA), eV:	-7.79(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-chlorophenyl)imino-3-(5-methyl-1,2-oxazol-3-yl)-1,3-thiazolidin-4-one

Drug info:

PubChemData

Smile

[BH-](C1=[N+](C=CN1C)C)(SC2=CC=CC=C2)SC3=CC=CC=C3

DOS

IR

Vibrations