Geometry & MOs

Info

ID:	74540
PubChem CID:	48422052
Reduced:	NO3C13H23 (1)
Stoich.:	AB3C13D23 (1)
Weight, g/mol:	315.219829
ΔH_f, kcal/mol:	-129.1
Dipole, Da:	3.63
IP(EA), eV:	-9.26(0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C(=O)N1CCC(CC1)OC)OCC2CC2

DOS

IR

Vibrations