Geometry & MOs

Info

ID:	274456
PubChem CID:	103809458
Reduced:	ClSN2O2C11H15 (1)
Stoich.:	ABC2D2E11F15 (1)
Weight, g/mol:	258.059362
ΔH_f, kcal/mol:	-63.58
Dipole, Da:	2.27
IP(EA), eV:	-9.43(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(azetidin-3-yl)-N-[2-(5-chlorothiophen-2-yl)ethyl]acetamide

Drug info:

PubChemData

Smile

C1COCC(N1)C(=O)NCCC2=CC=C(S2)Cl

DOS

IR

Vibrations