Geometry & MOs

Info

ID:	363960
PubChem CID:	127313629
Reduced:	ON4C15H20 (1)
Stoich.:	AB4C15D20 (1)
Weight, g/mol:	267.231063
ΔH_f, kcal/mol:	4.52
Dipole, Da:	5.8
IP(EA), eV:	-9.04(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,3-dimethylpiperidin-1-yl)-2-(4-methylpiperazin-1-yl)propan-1-one

Drug info:

PubChemData

Smile

CC1=NC2=C(C=NN2C=C1)C(=O)N3CCCC(C3)(C)C

DOS

IR

Vibrations