Geometry & MOs

Info

ID:	275251
PubChem CID:	103814832
Reduced:	OSN3C12H21 (1)
Stoich.:	ABC3D12E21 (1)
Weight, g/mol:	239.109233
ΔH_f, kcal/mol:	-45.32
Dipole, Da:	1.93
IP(EA), eV:	-9.5(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(azetidin-3-yl)-N-[(5-ethyl-1,3-thiazol-2-yl)methyl]acetamide

Drug info:

PubChemData

Smile

CCC1=CN=C(S1)CNC(=O)C(CC(C)C)N

DOS

IR

Vibrations