Geometry & MOs

Info

ID:	330052
PubChem CID:	127247039
Reduced:	ON7C17H19 (1)
Stoich.:	AB7C17D19 (1)
Weight, g/mol:	342.151433
ΔH_f, kcal/mol:	83.17
Dipole, Da:	6.82
IP(EA), eV:	-8.6(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-[2-[6-(dimethylamino)pyrazin-2-yl]pyrrolidin-1-yl]methanone

Drug info:

PubChemData

Smile

CN(C)C1=NC(=CN=C1)C2CCCN2C(=O)C3=C4N=CC=CN4N=C3

DOS

IR

Vibrations