Geometry & MOs

Info

ID:	55708
PubChem CID:	17395873
Reduced:	O2N3C17H23 (1)
Stoich.:	A2B3C17D23 (1)
Weight, g/mol:	340.142307
ΔH_f, kcal/mol:	-78.15
Dipole, Da:	0.82
IP(EA), eV:	-8.67(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-methoxy-4-phenylmethoxybenzoyl)piperazin-2-one

Drug info:

PubChemData

Smile

CC1C(=O)N(C(=O)N1C2=CC=C(C=C2)C)CN3CCCCC3

DOS

IR

Vibrations