Geometry & MOs

Info

ID:	272839
PubChem CID:	103761723
Reduced:	N5C14H19 (1)
Stoich.:	A5B14C19 (1)
Weight, g/mol:	273.147727
ΔH_f, kcal/mol:	108.87
Dipole, Da:	7.11
IP(EA), eV:	-9.44(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-1-[[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl]pyrrolidin-3-ol

Drug info:

PubChemData

Smile

CCCC1(CC1)CNC2=NN=NN2C3=CC=CC=C3

DOS

IR

Vibrations