Geometry & MOs

Info

ID:	76285
PubChem CID:	48424730
Reduced:	NO2C21H25 (1)
Stoich.:	AB2C21D25 (1)
Weight, g/mol:	303.183444
ΔH_f, kcal/mol:	-39.58
Dipole, Da:	3.48
IP(EA), eV:	-8.7(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-1-(4-phenoxypiperidin-1-yl)propan-1-one

Drug info:

PubChemData

Smile

CC(C(=O)N1CCCC1C2=CC=CC3=CC=CC=C32)OCC4CC4

DOS

IR

Vibrations