Geometry & MOs

Info

ID:	158361
PubChem CID:	56463510
Reduced:	SO2N3C19H25 (1)
Stoich.:	AB2C3D19E25 (1)
Weight, g/mol:	407.08445
ΔH_f, kcal/mol:	-13.04
Dipole, Da:	5.56
IP(EA), eV:	-9.16(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-bromophenoxy)-N-[1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-2-methylpropyl]propanamide

Drug info:

PubChemData

Smile

CC1CCC2=C(C1)C=C(S2)C(=O)NC(C3=NC(=NO3)C4CC4)C(C)C

DOS

IR

Vibrations