Geometry & MOs

Info

ID:	274461
PubChem CID:	103809482
Reduced:	ClSN2O2C12H17 (1)
Stoich.:	ABC2D2E12F17 (1)
Weight, g/mol:	272.075012
ΔH_f, kcal/mol:	-73.49
Dipole, Da:	3.76
IP(EA), eV:	-9.37(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-aminocyclobutyl)-N-[2-(5-chlorothiophen-2-yl)ethyl]acetamide

Drug info:

PubChemData

Smile

C1COC(CN1)CC(=O)NCCC2=CC=C(S2)Cl

DOS

IR

Vibrations