Geometry & MOs

Info

ID:	330980
PubChem CID:	127248387
Reduced:	SO3N4C23H26 (1)
Stoich.:	AB3C4D23E26 (1)
Weight, g/mol:	439.192963
ΔH_f, kcal/mol:	-52.18
Dipole, Da:	6.42
IP(EA), eV:	-9.05(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-[(2-methoxy-4-methylphenyl)methyl]morpholin-2-yl]-N-propan-2-ylthieno[2,3-b]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CN(C)C(=O)C1=C(C2=C(S1)N=CC=C2)C3CN(CCO3)C(=O)CCCC4=CC=CC=N4

DOS

IR

Vibrations