Geometry & MOs

Info

ID:	295567
PubChem CID:	117534384
Reduced:	ClSN2O2H9C11 (1)
Stoich.:	ABC2D2E9F11 (1)
Weight, g/mol:	228.093249
ΔH_f, kcal/mol:	-35.5
Dipole, Da:	6.13
IP(EA), eV:	-9.2(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(dimethylamino)-5-(2-methylpropyl)-1,3-thiazole-4-carboxylic acid

Drug info:

PubChemData

Smile

CNC1=NC(=C(S1)C2=CC(=CC=C2)Cl)C(=O)O

DOS

IR

Vibrations