Geometry & MOs

Info

ID:	199469
PubChem CID:	79251680
Reduced:	ION2H11C12 (1)
Stoich.:	ABC2D11E12 (1)
Weight, g/mol:	250.204513
ΔH_f, kcal/mol:	31.13
Dipole, Da:	4.5
IP(EA), eV:	-9.15(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-2-(octan-2-yloxymethyl)pyridin-4-amine

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)I)OCC2=NC=CC(=C2)N

DOS

IR

Vibrations