Geometry & MOs

Info

ID:	325719
PubChem CID:	126684626
Reduced:	NOC8H12 (2)
Stoich.:	ABC8D12 (2)
Weight, g/mol:	338.304562
ΔH_f, kcal/mol:	-85.53
Dipole, Da:	2.2
IP(EA), eV:	-8.76(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-dimethyl-4-(4-methylpiperazin-1-yl)-1-(4-propan-2-ylpiperazin-1-yl)pentan-1-one

Drug info:

PubChemData

Smile

CCC(C)C1=CC(=CC=C1)NC(=O)CN2CCOCC2

DOS

IR

Vibrations