Geometry & MOs

Info

ID:	330975
PubChem CID:	127248382
Reduced:	SN3O3C23H27 (1)
Stoich.:	AB3C3D23E27 (1)
Weight, g/mol:	439.192963
ΔH_f, kcal/mol:	-64.58
Dipole, Da:	2.18
IP(EA), eV:	-8.59(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)OCCCN2CCOC(C2)C3=C(SC4=C3C=CC=N4)C(=O)NC

DOS

IR

Vibrations