Geometry & MOs

Info

ID:	331026
PubChem CID:	127248433
Reduced:	SN4O4C19H26 (1)
Stoich.:	AB4C4D19E26 (1)
Weight, g/mol:	441.172228
ΔH_f, kcal/mol:	-121.89
Dipole, Da:	9.53
IP(EA), eV:	-8.97(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxyethyl)-3-[4-[(4-methoxyphenyl)methyl]morpholin-2-yl]-N-methylthieno[2,3-b]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CN(C)C(=O)CN1CCOC(C1)C2=C(SC3=C2C=CC=N3)C(=O)N(C)CCO

DOS

IR

Vibrations