Geometry & MOs

Info

ID:	351974
PubChem CID:	127282892
Reduced:	O2N5C21H29 (1)
Stoich.:	A2B5C21D29 (1)
Weight, g/mol:	365.279075
ΔH_f, kcal/mol:	-51.47
Dipole, Da:	8.19
IP(EA), eV:	-9.26(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[1-(cyclopropylamino)-1-oxopropan-2-yl]-N-[2-(4-methylpiperidin-1-yl)ethyl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1CCCC1)N2CCN(CC2)C(=O)NCC3=CC(=CC=C3)C#N

DOS

IR

Vibrations