Geometry & MOs

Info

ID:	354810
PubChem CID:	127287570
Reduced:	O3N4C17H18 (1)
Stoich.:	A3B4C17D18 (1)
Weight, g/mol:	264.129634
ΔH_f, kcal/mol:	-34.32
Dipole, Da:	3.45
IP(EA), eV:	-9.36(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-(1-methylpyrrolidin-3-yl)methanone

Drug info:

PubChemData

Smile

CC1=NN=C(O1)CC(=O)N2CCC(CC2)OC3=CC=CC(=C3)C#N

DOS

IR

Vibrations