Geometry & MOs

Info

ID:	331038
PubChem CID:	127248445
Reduced:	SO3N4C22H30 (1)
Stoich.:	AB3C4D22E30 (1)
Weight, g/mol:	416.188212
ΔH_f, kcal/mol:	-85.06
Dipole, Da:	9.18
IP(EA), eV:	-8.83(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-[2-(cyclohexylamino)-2-oxoethyl]morpholin-2-yl]-N-methylthieno[2,3-b]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CNC(=O)C1=C(C2=C(S1)N=CC=C2)C3CN(CCO3)CC(=O)N(C)C4CCCCC4

DOS

IR

Vibrations