Geometry & MOs

Info

ID:	418872
PubChem CID:	135107015
Reduced:	ClN2O2C16H21 (1)
Stoich.:	AB2C2D16E21 (1)
Weight, g/mol:	316.189926
ΔH_f, kcal/mol:	-70.68
Dipole, Da:	3.11
IP(EA), eV:	-8.69(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-1-[5-(2-propoxyphenyl)-1,3,4-oxadiazol-2-yl]pyrrolidin-3-amine

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)Cl)C(=O)N2C[C@H]3CN([C@@H](C2)COC3)C

DOS

IR

Vibrations