Geometry & MOs

Info

ID:	357785
PubChem CID:	127294572
Reduced:	ON2C10H18 (2)
Stoich.:	AB2C10D18 (2)
Weight, g/mol:	394.16166
ΔH_f, kcal/mol:	-121.92
Dipole, Da:	2.23
IP(EA), eV:	-8.56(0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-pyrrolidin-1-ylpiperidin-1-yl)-[4-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]phenyl]methanone

Drug info:

PubChemData

Smile

CN1CCCCC1CN2CCN(CC2)C(=O)CNC(=O)C3CCCCC3

DOS

IR

Vibrations