Geometry & MOs

Info

ID:	287362
PubChem CID:	104239200
Reduced:	ClF2N2O2C13H13 (1)
Stoich.:	AB2C2D2E13F13 (1)
Weight, g/mol:	297.060569
ΔH_f, kcal/mol:	-143.47
Dipole, Da:	3.93
IP(EA), eV:	-9.4(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(2-amino-2-phenylethyl)-1,3-thiazol-2-yl]methanesulfonamide

Drug info:

PubChemData

Smile

C[C@@H](C1=CC(=C(C=C1)OCC2=NC=CN2C(F)F)Cl)O

DOS

IR

Vibrations