Geometry & MOs

Info

ID:	75275
PubChem CID:	48423267
Reduced:	ClN2O2C19H27 (1)
Stoich.:	AB2C2D19E27 (1)
Weight, g/mol:	351.252192
ΔH_f, kcal/mol:	-61.64
Dipole, Da:	3.07
IP(EA), eV:	-8.88(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-1-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]propan-1-one

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1Cl)N2CCN(CC2)C(=O)C(C)OCC3CC3

DOS

IR

Vibrations