Geometry & MOs

Info

ID:	366245
PubChem CID:	127319702
Reduced:	SN3O4C17H21 (1)
Stoich.:	AB3C4D17E21 (1)
Weight, g/mol:	351.125277
ΔH_f, kcal/mol:	-154.65
Dipole, Da:	5.27
IP(EA), eV:	-9.03(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,1-dioxothian-3-yl)-2-(3-ethyl-2-oxobenzimidazol-1-yl)acetamide

Drug info:

PubChemData

Smile

CC1=C2C(=CC=C1)C(=O)N(C=N2)CCC(=O)NC3CCCS(=O)(=O)C3

DOS

IR

Vibrations