Geometry & MOs

Info

ID:	61369
PubChem CID:	26708650
Reduced:	S2N3O5H23C24 (1)
Stoich.:	A2B3C5D23E24 (1)
Weight, g/mol:	360.04994
ΔH_f, kcal/mol:	-128.33
Dipole, Da:	6.11
IP(EA), eV:	-9.24(-1.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-2-fluoro-N-[5-[(3-methylphenyl)methyl]-1,3-thiazol-2-yl]benzamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)CC2=CN=C(S2)NC(=O)[C@H](CCS(=O)(=O)C)N3C(=O)C4=CC=CC=C4C3=O

DOS

IR

Vibrations