Geometry & MOs

Info

ID:	155985
PubChem CID:	56368608
Reduced:	BrON3C18H26 (1)
Stoich.:	ABC3D18E26 (1)
Weight, g/mol:	443.232125
ΔH_f, kcal/mol:	-57.4
Dipole, Da:	4.61
IP(EA), eV:	-8.83(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-benzyl-5-(2-methylphenyl)pyrazol-3-yl]-4-(3-propyl-1,2,4-oxadiazol-5-yl)butanamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC(=NN1)NC(=O)C23CC4CC(C2)CC(C4)(C3)Br

DOS

IR

Vibrations