Geometry & MOs

Info

ID:	330985
PubChem CID:	127248392
Reduced:	SO3N4C24H24 (1)
Stoich.:	AB3C4D24E24 (1)
Weight, g/mol:	437.177313
ΔH_f, kcal/mol:	-29.09
Dipole, Da:	2.59
IP(EA), eV:	-9.13(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-[(2,2-dimethyl-3H-1-benzofuran-5-yl)methyl]morpholin-2-yl]-N-methylthieno[2,3-b]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

C1COC(CN1CC2=C3C=CC=NC3=CC=C2)C4=C(SC5=C4C=CC=N5)C(=O)NCCO

DOS

IR

Vibrations