Geometry & MOs

Info

ID:	356752
PubChem CID:	127292233
Reduced:	O2N5C20H39 (1)
Stoich.:	A2B5C20D39 (1)
Weight, g/mol:	312.216141
ΔH_f, kcal/mol:	-105.86
Dipole, Da:	6.24
IP(EA), eV:	-8.48(1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCN1CCN(CC1)C2CCN(C2)C(=O)NCC(C(C)C)N3CCOCC3

DOS

IR

Vibrations