Geometry & MOs

Info

ID:	243279
PubChem CID:	99218162
Reduced:	ClFON2S2H10C15 (1)
Stoich.:	ABCD2E2F10G15 (1)
Weight, g/mol:	461.077632
ΔH_f, kcal/mol:	-9.53
Dipole, Da:	6.46
IP(EA), eV:	-8.94(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(3-chloro-4-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-fluorobenzoyl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(SC=C1)C(=O)NC2=NC(=CS2)C3=CC(=C(C=C3)F)Cl

DOS

IR

Vibrations