Geometry & MOs

Info

ID:	76083
PubChem CID:	48424404
Reduced:	NO3C13H23 (1)
Stoich.:	AB3C13D23 (1)
Weight, g/mol:	329.199094
ΔH_f, kcal/mol:	-136.32
Dipole, Da:	2.52
IP(EA), eV:	-9.7(0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-1-[4-(4-methylbenzoyl)piperidin-1-yl]propan-1-one

Drug info:

PubChemData

Smile

CC(C(=O)NCC1CCCOC1)OCC2CC2

DOS

IR

Vibrations