Geometry & MOs

Info

ID:	164716
PubChem CID:	74442701
Reduced:	N2O2C9H11 (2)
Stoich.:	A2B2C9D11 (2)
Weight, g/mol:	448.156912
ΔH_f, kcal/mol:	-99.7
Dipole, Da:	6.06
IP(EA), eV:	-9.32(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-methyl-5-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-3-yl]naphthalene-2-sulfonamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=NOC(=N2)C3CC(CN3C)NC(=O)CCC(=O)O

DOS

IR

Vibrations