Geometry & MOs

Info

ID:	158162
PubChem CID:	56463082
Reduced:	SO3N4H20C21 (1)
Stoich.:	AB3C4D20E21 (1)
Weight, g/mol:	427.247107
ΔH_f, kcal/mol:	31.59
Dipole, Da:	5.23
IP(EA), eV:	-9.35(-1.56)
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]-4-oxo-4-(4-pentoxyphenyl)butanamide

Drug info:

PubChemData

Smile

CC(C)C(C1=NC(=NO1)C2CC2)NC(=O)C3=CC=C(O3)C4=NC5=CC=CC=C5S4

DOS

IR

Vibrations