Geometry & MOs

Info

ID:	56324
PubChem CID:	17425102
Reduced:	ClFON2C12H16 (1)
Stoich.:	ABCD2E12F16 (1)
Weight, g/mol:	370.107517
ΔH_f, kcal/mol:	-94.37
Dipole, Da:	4.55
IP(EA), eV:	-9.07(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]-N-[2-(trifluoromethyl)phenyl]acetamide

Drug info:

PubChemData

Smile

CC(C)(C)NCC(=O)NC1=C(C=CC(=C1)Cl)F

DOS

IR

Vibrations