Geometry & MOs

Info

ID:	366228
PubChem CID:	127319677
Reduced:	N2S2O3C13H18 (1)
Stoich.:	A2B2C3D13E18 (1)
Weight, g/mol:	305.129694
ΔH_f, kcal/mol:	-110.25
Dipole, Da:	3.93
IP(EA), eV:	-9.46(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,1-dioxothian-3-yl)-2-(oxolan-2-ylmethoxy)propanamide

Drug info:

PubChemData

Smile

C1CC(CS(=O)(=O)C1)NC(=O)CSCC2=CC=NC=C2

DOS

IR

Vibrations