Geometry & MOs

Info

ID:	274737
PubChem CID:	103811366
Reduced:	ON5C11H19 (1)
Stoich.:	AB5C11D19 (1)
Weight, g/mol:	228.220164
ΔH_f, kcal/mol:	-13.79
Dipole, Da:	5.25
IP(EA), eV:	-9.59(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-amino-N-(3-methylpentan-3-yl)heptanamide

Drug info:

PubChemData

Smile

C1CCN[C@@H](C1)C(=O)NCCCC2=NC=NN2

DOS

IR

Vibrations