Geometry & MOs

Info

ID:	145840
PubChem CID:	53600800
Reduced:	O2N5C17H31 (1)
Stoich.:	A2B5C17D31 (1)
Weight, g/mol:	341.221561
ΔH_f, kcal/mol:	-66.94
Dipole, Da:	5.28
IP(EA), eV:	-8.79(0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[[2-[2-(1-ethylpyrrolidin-2-yl)pyrrolidin-1-yl]-2-oxoethyl]-methylamino]pyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CC1=NN(C(=N1)C)CC2CCCN(C2)CC(CN3CCOCC3)O

DOS

IR

Vibrations