Geometry & MOs

Info

ID:	347951
PubChem CID:	127273013
Reduced:	O2N4C13H24 (1)
Stoich.:	A2B4C13D24 (1)
Weight, g/mol:	321.252861
ΔH_f, kcal/mol:	-97.43
Dipole, Da:	4.75
IP(EA), eV:	-8.29(0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-methylpiperazin-1-yl)propyl]-2-(1,3,5-trimethylpyrazol-4-yl)propanamide

Drug info:

PubChemData

Smile

CC(CNC(=O)C1CC(=O)NC1)N2CCN(CC2)C

DOS

IR

Vibrations