Geometry & MOs

Info

ID:	330875
PubChem CID:	127248282
Reduced:	SN3O4C21H27 (1)
Stoich.:	AB3C4D21E27 (1)
Weight, g/mol:	430.203862
ΔH_f, kcal/mol:	-135.11
Dipole, Da:	1.79
IP(EA), eV:	-9.22(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-diethyl-2-[3-[2-(morpholine-4-carbonyl)thieno[2,3-b]pyridin-3-yl]pyrrolidin-1-yl]acetamide

Drug info:

PubChemData

Smile

CC(C)OCC(=O)N1CCC(C1)C2=C(SC3=C2C=CC=N3)C(=O)N4CCOCC4

DOS

IR

Vibrations