Geometry & MOs

Info

ID:	330984
PubChem CID:	127248391
Reduced:	SO2N4C24H24 (1)
Stoich.:	AB2C4D24E24 (1)
Weight, g/mol:	448.156912
ΔH_f, kcal/mol:	23.18
Dipole, Da:	4.99
IP(EA), eV:	-8.98(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxyethyl)-3-[4-(quinolin-5-ylmethyl)morpholin-2-yl]thieno[2,3-b]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CN(C)C(=O)C1=C(C2=C(S1)N=CC=C2)C3CN(CCO3)CC4=C5C=CC=NC5=CC=C4

DOS

IR

Vibrations