Geometry & MOs

Info

ID:	349853
PubChem CID:	127276245
Reduced:	O2N3C22H31 (1)
Stoich.:	A2B3C22D31 (1)
Weight, g/mol:	341.210327
ΔH_f, kcal/mol:	-71.82
Dipole, Da:	4.82
IP(EA), eV:	-8.71(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-oxo-1-[2-(piperidin-1-ylmethyl)pyrrolidin-1-yl]propan-2-yl]oxybenzonitrile

Drug info:

PubChemData

Smile

CC1CC1C(=O)NC2=CC=CC(=C2)C(=O)N3CCCC3CN4CCCCC4

DOS

IR

Vibrations