Geometry & MOs

Info

ID:	158599
PubChem CID:	56464281
Reduced:	ClSN3O5C23H30 (1)
Stoich.:	ABC3D5E23F30 (1)
Weight, g/mol:	438.19032
ΔH_f, kcal/mol:	-154.83
Dipole, Da:	10.01
IP(EA), eV:	-8.62(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-2-methylpropyl]-1,3-dioxo-2-(oxolan-2-ylmethyl)isoindole-5-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)NCC(C)N(C)C2CC2)S(=O)(=O)NC3=CC(=C(C=C3OC)OC)Cl

DOS

IR

Vibrations