Geometry & MOs

Info

ID:	55116
PubChem CID:	17389783
Reduced:	NOH11C12 (2)
Stoich.:	ABC11D12 (2)
Weight, g/mol:	228.102941
ΔH_f, kcal/mol:	7.91
Dipole, Da:	3.19
IP(EA), eV:	-9.12(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-amino-1-pyridin-3-ylhexan-1-one;hydrochloride

Drug info:

PubChemData

Smile

C=CN1CCCCC(C1=O)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4

DOS

IR

Vibrations