Geometry & MOs

Info

ID:	268356
PubChem CID:	103599059
Reduced:	FSN3O6H12C14 (1)
Stoich.:	ABC3D6E12F14 (1)
Weight, g/mol:	336.058006
ΔH_f, kcal/mol:	-133.12
Dipole, Da:	6.39
IP(EA), eV:	-10.68(-2.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-methyl-1,3-thiazol-5-yl)ethyl 3-(4-fluoro-2-nitrophenyl)prop-2-enoate

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)S(=O)(=O)NC(=O)C=CC2=C(C=C(C=C2)F)[N+](=O)[O-]

DOS

IR

Vibrations