Geometry & MOs

Info

ID:	159478
PubChem CID:	57288138
Reduced:	O3C11H24 (1)
Stoich.:	A3B11C24 (1)
Weight, g/mol:	281.173942
ΔH_f, kcal/mol:	-185.48
Dipole, Da:	1.99
IP(EA), eV:	-10.14(1.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(7,7-diaminoheptan-2-yl)-2,3-dihydroxybenzamide

Drug info:

PubChemData

Smile

CCCC(OCCC)OCC(C)(C)O

DOS

IR

Vibrations