Geometry & MOs

Info

ID:	157425
PubChem CID:	56424123
Reduced:	FSN3O3C21H24 (1)
Stoich.:	ABC3D3E21F24 (1)
Weight, g/mol:	441.244999
ΔH_f, kcal/mol:	-146.76
Dipole, Da:	4.21
IP(EA), eV:	-9.16(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1-oxopentan-2-yl]-4-[[ethyl(propan-2-yl)amino]methyl]benzamide

Drug info:

PubChemData

Smile

CCCC(C(=O)N1CCC2=C(C1)C=CS2)NC(=O)C3=C(C=CC(=C3)NC(=O)C)F

DOS

IR

Vibrations