Geometry & MOs

Info

ID:	130192
PubChem CID:	51075207
Reduced:	OSN2C11H16 (1)
Stoich.:	ABC2D11E16 (1)
Weight, g/mol:	331.225977
ΔH_f, kcal/mol:	-14.77
Dipole, Da:	3.03
IP(EA), eV:	-8.88(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-morpholin-4-yl-1-[4-(3-phenylpropyl)piperazin-1-yl]ethanone

Drug info:

PubChemData

Smile

CN(C)C(=O)CN1CCC2=C(C1)C=CS2

DOS

IR

Vibrations