Geometry & MOs

Info

ID:	364898
PubChem CID:	127316486
Reduced:	ON2C10H13 (2)
Stoich.:	AB2C10D13 (2)
Weight, g/mol:	399.252192
ΔH_f, kcal/mol:	-3.32
Dipole, Da:	3.66
IP(EA), eV:	-8.59(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(4-cyclobutylpiperazine-1-carbonyl)piperidin-1-yl]-3-phenoxypropan-1-one

Drug info:

PubChemData

Smile

CCOC1=CN(N=C1C(=O)N2CCN(CC2)C3CCC3)C4=CC=CC=C4

DOS

IR

Vibrations