Geometry & MOs

Info

ID:	358205
PubChem CID:	127295750
Reduced:	ClO2N4C16H21 (1)
Stoich.:	AB2C4D16E21 (1)
Weight, g/mol:	385.284161
ΔH_f, kcal/mol:	-52.56
Dipole, Da:	0.9
IP(EA), eV:	-9.26(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[6-(4-methylpiperidin-1-yl)pyridin-3-yl]methyl]-3-piperidin-1-ylpyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CN(CC1CCCOC1)C(=O)NCC2=CN3C=C(C=CC3=N2)Cl

DOS

IR

Vibrations