Geometry & MOs

Info

ID:	440669
PubChem CID:	135230876
Reduced:	ON3C13H23 (1)
Stoich.:	AB3C13D23 (1)
Weight, g/mol:	214.168128
ΔH_f, kcal/mol:	-44.88
Dipole, Da:	5.22
IP(EA), eV:	-9.28(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,9-diamino-3,6-dimethylnonane-2,7-dione

Drug info:

PubChemData

Smile

CCCC(CCC)C(=O)[C@H](CC1=CN=CN1)N

DOS

IR

Vibrations