Geometry & MOs

Info

ID:	290063
PubChem CID:	104405187
Reduced:	O3N4C14H18 (1)
Stoich.:	A3B4C14D18 (1)
Weight, g/mol:	295.262363
ΔH_f, kcal/mol:	-69.99
Dipole, Da:	4.09
IP(EA), eV:	-8.25(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(1-propylpiperidin-3-yl)ethylamino]-1-pyrrolidin-1-ylpropan-1-one

Drug info:

PubChemData

Smile

CC(C(=O)N1CCOCC1)NC2=NC3=C(O2)C=C(C=C3)N

DOS

IR

Vibrations