Geometry & MOs

Info

ID:	275258
PubChem CID:	103814869
Reduced:	SO2N3C10H17 (1)
Stoich.:	AB2C3D10E17 (1)
Weight, g/mol:	295.054611
ΔH_f, kcal/mol:	-63.86
Dipole, Da:	3.67
IP(EA), eV:	-9.54(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC1=CN=C(S1)CNC(=O)COCCN

DOS

IR

Vibrations