Geometry & MOs

Info

ID:	259401
PubChem CID:	103165289
Reduced:	OSN2C15H20 (1)
Stoich.:	ABC2D15E20 (1)
Weight, g/mol:	306.140199
ΔH_f, kcal/mol:	28.83
Dipole, Da:	3.41
IP(EA), eV:	-9.3(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[5-(3-aminoprop-1-ynyl)thiophen-2-yl]methyl]-2-(3-ethoxycyclobutyl)acetamide

Drug info:

PubChemData

Smile

CN(CC1=CSC(=C1)C#CCN)C(=O)CC2CCC2

DOS

IR

Vibrations