Geometry & MOs

Info

ID:	350683
PubChem CID:	127278971
Reduced:	SO2N3C20H23 (1)
Stoich.:	AB2C3D20E23 (1)
Weight, g/mol:	329.177313
ΔH_f, kcal/mol:	-56.64
Dipole, Da:	6.97
IP(EA), eV:	-9.02(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3,3-dimethylmorpholin-4-yl)ethyl]-3-propanoyl-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

C1CCC(C(C1)CC2=CC=CC=C2)NC(=O)C3=CN=C4N(C3=O)CCS4

DOS

IR

Vibrations