Geometry & MOs

Info

ID:	347971
PubChem CID:	127273033
Reduced:	O3N4C16H30 (1)
Stoich.:	A3B4C16D30 (1)
Weight, g/mol:	321.252861
ΔH_f, kcal/mol:	-144.85
Dipole, Da:	2.28
IP(EA), eV:	-8.47(0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(CNC(=O)CCC(=O)N1CCOCC1)N2CCN(CC2)C

DOS

IR

Vibrations