Geometry & MOs

Info

ID:	146167
PubChem CID:	53646366
Reduced:	ClN2O3C8H8 (2)
Stoich.:	AB2C3D8E8 (2)
Weight, g/mol:	290.89989
ΔH_f, kcal/mol:	-110.73
Dipole, Da:	8.27
IP(EA), eV:	-9.91(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-bromo-2,3,3-trifluoropropyl)sulfanyl-1,3-thiazole

Drug info:

PubChemData

Smile

CN(C)C(=O)C(=NOC(=O)C1=CC(=CC=C1)C(=O)ON=C(C(=O)N(C)C)Cl)Cl

DOS

IR

Vibrations