Geometry & MOs

Info

ID:	264077
PubChem CID:	103426218
Reduced:	SO3N4C13H22 (1)
Stoich.:	AB3C4D13E22 (1)
Weight, g/mol:	269.156184
ΔH_f, kcal/mol:	-132.82
Dipole, Da:	5.54
IP(EA), eV:	-8.41(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-amino-5-[3-(dimethylamino)propylamino]thiophen-2-yl]-2-methylpropan-1-one

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(C(=C(S1)NCCCN(C)C)C(=O)N)N

DOS

IR

Vibrations