Geometry & MOs

Info

ID:	349777
PubChem CID:	127276169
Reduced:	ON3C10H14 (2)
Stoich.:	AB3C10D14 (2)
Weight, g/mol:	276.114378
ΔH_f, kcal/mol:	9.93
Dipole, Da:	6.43
IP(EA), eV:	-8.55(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(1,1-dioxo-1,2-thiazolidin-2-yl)ethyl]oxane-3-carboxamide

Drug info:

PubChemData

Smile

CC1CCC(N1C2CCCN(C2)C(=O)CCC3=NC(=NO3)C4=NC=CC=N4)C

DOS

IR

Vibrations