Geometry & MOs

Info

ID:	282214
PubChem CID:	103918950
Reduced:	N3O4C12H19 (1)
Stoich.:	A3B4C12D19 (1)
Weight, g/mol:	263.119129
ΔH_f, kcal/mol:	-96.31
Dipole, Da:	3.41
IP(EA), eV:	-10.12(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-hydroxyhexyl)-1,1-dioxothiolane-3-carboxamide

Drug info:

PubChemData

Smile

CN1C=C(C=C1C(=O)NCCCCCCO)[N+](=O)[O-]

DOS

IR

Vibrations