Geometry & MOs

Info

ID:	343893
PubChem CID:	127267069
Reduced:	N4C19H26 (1)
Stoich.:	A4B19C26 (1)
Weight, g/mol:	312.195011
ΔH_f, kcal/mol:	47.11
Dipole, Da:	3.53
IP(EA), eV:	-8.71(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[[1-(2-methoxyphenyl)piperidin-4-yl]amino]methyl]pyridin-3-amine

Drug info:

PubChemData

Smile

CC(C)(CNCC1=C(C=NC=C1)N)N2CCC3=CC=CC=C3C2

DOS

IR

Vibrations