Geometry & MOs

Info

ID:	275049
PubChem CID:	103813444
Reduced:	OSN3C12H19 (1)
Stoich.:	ABC3D12E19 (1)
Weight, g/mol:	239.109233
ΔH_f, kcal/mol:	-39.46
Dipole, Da:	4.3
IP(EA), eV:	-9.24(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(azetidin-3-yl)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]acetamide

Drug info:

PubChemData

Smile

CC1=NC(=CS1)CCNC(=O)C2CCCC2N

DOS

IR

Vibrations