Geometry & MOs

Info

ID:	432216
PubChem CID:	135172348
Reduced:	O5C21H34 (1)
Stoich.:	A5B21C34 (1)
Weight, g/mol:	434.243024
ΔH_f, kcal/mol:	-261.72
Dipole, Da:	5.07
IP(EA), eV:	-10.06(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(2-ethoxypyridin-3-yl)-4-N-[(4-methoxypyridin-2-yl)methyl]-2-N-methyl-3-(2-methylpropanimidoyl)pyridine-2,4-diamine

Drug info:

PubChemData

Smile

CCCCCC(=O)CCC[C@H]1[C@@H](CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O

DOS

IR

Vibrations