Geometry & MOs

Info

ID:	320460
PubChem CID:	126661272
Reduced:	N5H9C14 (1)
Stoich.:	A5B9C14 (1)
Weight, g/mol:	282.176585
ΔH_f, kcal/mol:	165.87
Dipole, Da:	5.38
IP(EA), eV:	-9.48(-1.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-4-(5-propan-2-ylsulfinylpyridin-3-yl)hexan-1-amine

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)N=NN2C3=CN=CC(=C3)/C=C/C#N

DOS

IR

Vibrations