Geometry & MOs

Info

ID:	47767
PubChem CID:	10535188
Reduced:	NC12H13 (1)
Stoich.:	AB12C13 (1)
Weight, g/mol:	171.162314
ΔH_f, kcal/mol:	74.75
Dipole, Da:	1.59
IP(EA), eV:	-8.85(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-4-amino-2-methylnonan-5-one

Drug info:

PubChemData

Smile

C=CCN=C=CCC1=CC=CC=C1

DOS

IR

Vibrations