Geometry & MOs

Info

ID:	155918
PubChem CID:	56368294
Reduced:	O2N3C27H29 (1)
Stoich.:	A2B3C27D29 (1)
Weight, g/mol:	425.231456
ΔH_f, kcal/mol:	-19.32
Dipole, Da:	7.9
IP(EA), eV:	-9.36(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(4-methoxyphenoxy)propyl]-4-[2-(4-methylphenyl)acetyl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CN(CC1=CC=CC=C1C2=CC=CC=C2)C(=O)NCC3=CC(=CC=C3)C(=O)N4CCCC4

DOS

IR

Vibrations