Geometry & MOs

Info

ID:	357105
PubChem CID:	127293331
Reduced:	O2N4C21H38 (1)
Stoich.:	A2B4C21D38 (1)
Weight, g/mol:	321.252861
ΔH_f, kcal/mol:	-133.85
Dipole, Da:	6.07
IP(EA), eV:	-8.37(1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(CN1CCN(CC1)C)NC(=O)C2CCC(CC2)NC(=O)C3CCCC3

DOS

IR

Vibrations