Geometry & MOs

Info

ID:	349973
PubChem CID:	127276778
Reduced:	SO2N4C19H24 (1)
Stoich.:	AB2C4D19E24 (1)
Weight, g/mol:	342.118418
ΔH_f, kcal/mol:	-4.3
Dipole, Da:	3.48
IP(EA), eV:	-8.74(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[(5-ethoxy-1,3,4-thiadiazol-2-yl)methyl]pyrrolidin-2-yl]-thiomorpholin-4-ylmethanone

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C2=NOC(=N2)CN3CCCC3C(=O)N4CCSCC4

DOS

IR

Vibrations