Geometry & MOs

Info

ID:	126073
PubChem CID:	50950521
Reduced:	N2O4C19H28 (1)
Stoich.:	A2B4C19D28 (1)
Weight, g/mol:	316.178693
ΔH_f, kcal/mol:	-173.14
Dipole, Da:	7.83
IP(EA), eV:	-8.63(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-3-benzyl-4-[1-(methoxymethyl)cyclobutanecarbonyl]piperazin-2-one

Drug info:

PubChemData

Smile

CCN(CC1CCOCC1)C(=O)CC(=O)NC2=CC=CC=C2OCC

DOS

IR

Vibrations