Geometry & MOs

Info

ID:	277929
PubChem CID:	103831981
Reduced:	ON3C17H35 (1)
Stoich.:	AB3C17D35 (1)
Weight, g/mol:	277.19026
ΔH_f, kcal/mol:	-90.91
Dipole, Da:	4.1
IP(EA), eV:	-8.65(1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-1-(4-pyrazin-2-ylpiperazin-1-yl)hexan-1-one

Drug info:

PubChemData

Smile

CCCC[C@@H](C(=O)N1CCC(CC1)CN(C)CCCC)N

DOS

IR

Vibrations