Geometry & MOs

Info

ID:	211719
PubChem CID:	81050817
Reduced:	FOCl2H13C15 (1)
Stoich.:	ABC2D13E15 (1)
Weight, g/mol:	263.199762
ΔH_f, kcal/mol:	-66.83
Dipole, Da:	2.26
IP(EA), eV:	-9.08(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(aminomethyl)-N,2,6-trimethyl-N-(oxan-4-ylmethyl)pyridin-4-amine

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1F)Cl)C(C2=CC=CC=C2OC)Cl

DOS

IR

Vibrations