Geometry & MOs

Info

ID:	158665
PubChem CID:	56464546
Reduced:	O2N3C20H33 (1)
Stoich.:	A2B3C20D33 (1)
Weight, g/mol:	434.09535
ΔH_f, kcal/mol:	-63.37
Dipole, Da:	4.02
IP(EA), eV:	-10.11(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-N-[3-[[1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-2-methylpropyl]amino]-3-oxopropyl]benzamide

Drug info:

PubChemData

Smile

CCCCC1CCC(CC1)C(=O)NC(C2=NC(=NO2)C3CC3)C(C)C

DOS

IR

Vibrations