Geometry & MOs

Info

ID:	306216
PubChem CID:	125002794
Reduced:	O2N6C17H24 (1)
Stoich.:	A2B6C17D24 (1)
Weight, g/mol:	313.179027
ΔH_f, kcal/mol:	21.12
Dipole, Da:	3.28
IP(EA), eV:	-8.85(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-methoxyphenyl)-1-[(3R)-3-(5-methyl-1H-imidazol-2-yl)piperidin-1-yl]ethanone

Drug info:

PubChemData

Smile

CC1=NON=C1CC(=O)N2CCC[C@@H](CC2)CC3=CN=C(C=N3)NC

DOS

IR

Vibrations