Geometry & MOs

Info

ID:	445894
PubChem CID:	135269887
Reduced:	ON3H11C12 (2)
Stoich.:	AB3C11D12 (2)
Weight, g/mol:	333.241627
ΔH_f, kcal/mol:	70.46
Dipole, Da:	2.58
IP(EA), eV:	-9.3(-1.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(4-benzyl-3,5-dimethylpiperazin-1-yl)-N-hydroxyhexanamide

Drug info:

PubChemData

Smile

CC1=NC=C(N=C1C2=NN=C(O2)C3=CC=CC=C3)C4=CC=C(C=C4)C(=O)N5CCNCC5

DOS

IR

Vibrations