Geometry & MOs

Info

ID:	31334
PubChem CID:	855588
Reduced:	ON5C19H27 (1)
Stoich.:	AB5C19D27 (1)
Weight, g/mol:	342.083827
ΔH_f, kcal/mol:	28.91
Dipole, Da:	6.47
IP(EA), eV:	-8.93(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-N-methyl-2-phenoxyacetamide

Drug info:

PubChemData

Smile

CC1CCN(CC1)[C@H](C2=CC=C(C=C2)O)C3=NN=NN3C4CCCC4

DOS

IR

Vibrations