Geometry & MOs

Info

ID:	245576
PubChem CID:	99454031
Reduced:	SO2N4C19H24 (1)
Stoich.:	AB2C4D19E24 (1)
Weight, g/mol:	359.148121
ΔH_f, kcal/mol:	-35.01
Dipole, Da:	5.05
IP(EA), eV:	-8.78(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3aR,7aR)-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl]-N-[6-(2-methoxyethoxy)pyridin-3-yl]acetamide

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)N2C=CN=C2SCC(=O)NNC(=O)C3CCCC3)C

DOS

IR

Vibrations