Geometry & MOs

Info

ID:	351424
PubChem CID:	127280312
Reduced:	SO2N3C17H23 (1)
Stoich.:	AB2C3D17E23 (1)
Weight, g/mol:	331.189592
ΔH_f, kcal/mol:	-51.68
Dipole, Da:	6.85
IP(EA), eV:	-9.02(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl)-N-methyl-N-(2-pyrrolidin-1-ylethyl)acetamide

Drug info:

PubChemData

Smile

CN(CCN1CCCC1)C(=O)C2=CC3=C(C=C2)SCCC(=O)N3

DOS

IR

Vibrations