Geometry & MOs

Info

ID:	129668
PubChem CID:	51073509
Reduced:	BrO2N3H14C15 (1)
Stoich.:	AB2C3D14E15 (1)
Weight, g/mol:	297.01129
ΔH_f, kcal/mol:	42.71
Dipole, Da:	2.69
IP(EA), eV:	-9.35(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-bromofuran-2-yl)-5-(pyrrolidin-1-ylmethyl)-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

CN(CC1=CC=CC=C1)CC2=NN=C(O2)C3=CC=C(O3)Br

DOS

IR

Vibrations