Geometry & MOs

Info

ID:	172491
PubChem CID:	75516071
Reduced:	ON4C19H22 (1)
Stoich.:	AB4C19D22 (1)
Weight, g/mol:	346.236876
ΔH_f, kcal/mol:	23.21
Dipole, Da:	4.15
IP(EA), eV:	-9.11(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-[[(2,6-dimethyloxan-4-yl)amino]methyl]pyridin-2-yl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCC(C1=CC=NC=C1)N(C)CC2=NC3=CC=CC=C3C(=O)N2C

DOS

IR

Vibrations