Geometry & MOs

Info

ID:	269066
PubChem CID:	103609683
Reduced:	NO3C16H17 (1)
Stoich.:	AB3C16D17 (1)
Weight, g/mol:	292.153541
ΔH_f, kcal/mol:	-76.05
Dipole, Da:	1.73
IP(EA), eV:	-9.23(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[[1-(2-amino-2-oxoethyl)piperidin-4-yl]amino]pyridine-4-carboxylate

Drug info:

PubChemData

Smile

CC(C)C1=CC(=CC=C1)OC2=NC=CC(=C2)C(=O)OC

DOS

IR

Vibrations