Geometry & MOs

Info

ID:	331722
PubChem CID:	127249805
Reduced:	SO2N6C23H24 (1)
Stoich.:	AB2C6D23E24 (1)
Weight, g/mol:	433.102017
ΔH_f, kcal/mol:	29.63
Dipole, Da:	2.47
IP(EA), eV:	-8.64(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,4-difluorophenoxy)-1-[2-[6-(1,3,4-thiadiazol-2-ylamino)pyridin-2-yl]morpholin-4-yl]ethanone

Drug info:

PubChemData

Smile

CCC1=NN=C(S1)NC2=CC=CC(=N2)C3CN(CCO3)C(=O)C4=CC5=C(C=CC=C5N4)C

DOS

IR

Vibrations