Geometry & MOs

Info

ID:	351167
PubChem CID:	127279725
Reduced:	N3O3C23H31 (1)
Stoich.:	A3B3C23D31 (1)
Weight, g/mol:	336.150764
ΔH_f, kcal/mol:	-131.72
Dipole, Da:	7.28
IP(EA), eV:	-8.57(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(2-cyclopentylacetyl)amino]ethyl]-6,7-dihydro-4H-thieno[3,2-c]pyran-2-carboxamide

Drug info:

PubChemData

Smile

C1CC2CC(CC(C1)C2=O)C(=O)NC3=CC=C(C=C3)CN4CCCC(C4)C(=O)N

DOS

IR

Vibrations