Geometry & MOs

Info

ID:	331010
PubChem CID:	127248417
Reduced:	FSN3O3C23H24 (1)
Stoich.:	ABC3D3E23F24 (1)
Weight, g/mol:	404.151826
ΔH_f, kcal/mol:	-100.13
Dipole, Da:	4.7
IP(EA), eV:	-9.0(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-(4-amino-4-oxobutanoyl)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)CCC4=CC=C(C=C4)F

DOS

IR

Vibrations