Geometry & MOs

Info

ID:	330978
PubChem CID:	127248385
Reduced:	SO2N5C24H27 (1)
Stoich.:	AB2C5D24E27 (1)
Weight, g/mol:	437.140927
ΔH_f, kcal/mol:	-3.02
Dipole, Da:	2.84
IP(EA), eV:	-8.56(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[2-(morpholine-4-carbonyl)thieno[2,3-b]pyridin-3-yl]morpholin-4-yl]-phenylmethanone

Drug info:

PubChemData

Smile

CC1=C(N2C=CC=CC2=N1)CN3CCOC(C3)C4=C(SC5=C4C=CC=N5)C(=O)NC(C)C

DOS

IR

Vibrations