Geometry & MOs

Info

ID:	356756
PubChem CID:	127292237
Reduced:	ClON6C19H27 (1)
Stoich.:	ABC6D19E27 (1)
Weight, g/mol:	326.231791
ΔH_f, kcal/mol:	-0.24
Dipole, Da:	4.62
IP(EA), eV:	-8.53(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-(4-methyl-2-morpholin-4-ylpentyl)-3-oxopiperazine-1-carboxamide

Drug info:

PubChemData

Smile

CCN1CCN(CC1)C2CCN(C2)C(=O)NCC3=CN4C=C(C=CC4=N3)Cl

DOS

IR

Vibrations