Geometry & MOs

Info

ID:	158543
PubChem CID:	56464154
Reduced:	SO3N4C20H26 (1)
Stoich.:	AB3C4D20E26 (1)
Weight, g/mol:	435.192484
ΔH_f, kcal/mol:	-50.86
Dipole, Da:	6.19
IP(EA), eV:	-9.13(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-butoxy-3-chloro-N-[1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-2-methylpropyl]-5-ethoxybenzamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)NC(=O)CSCC(=O)NC(C2=NC(=NO2)C3CC3)C(C)C

DOS

IR

Vibrations