Geometry & MOs

Info

ID:	158188
PubChem CID:	56463127
Reduced:	BrFO2N3C18H19 (1)
Stoich.:	ABC2D3E18F19 (1)
Weight, g/mol:	433.097538
ΔH_f, kcal/mol:	-23.16
Dipole, Da:	4.69
IP(EA), eV:	-9.93(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-[1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-2-methylpropyl]acetamide

Drug info:

PubChemData

Smile

CC(C)C(C1=NC(=NO1)C2CC2)NC(=O)/C=C/C3=C(C=CC(=C3)Br)F

DOS

IR

Vibrations