Geometry & MOs

Info

ID:	137214
PubChem CID:	52171159
Reduced:	SO3N4C20H20 (1)
Stoich.:	AB3C4D20E20 (1)
Weight, g/mol:	296.155849
ΔH_f, kcal/mol:	-36.18
Dipole, Da:	5.61
IP(EA), eV:	-8.55(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2R)-3-methyl-2-morpholin-4-ylbutyl]-2-thiophen-2-ylacetamide

Drug info:

PubChemData

Smile

CN1C=CN=C1SC2=CC=C(C=C2)NC(=O)CNC(=O)C3=CC(=CC=C3)OC

DOS

IR

Vibrations