Geometry & MOs

Info

ID:	365737
PubChem CID:	127318462
Reduced:	O2N3C18H27 (1)
Stoich.:	A2B3C18D27 (1)
Weight, g/mol:	371.220892
ΔH_f, kcal/mol:	-86.9
Dipole, Da:	1.96
IP(EA), eV:	-8.85(0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(3-piperidin-1-ylpropanoylamino)phenyl]-7-oxabicyclo[2.2.1]heptane-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=CN2CC(CCC2=N1)NC(=O)C3CC4CCC3O4

DOS

IR

Vibrations