Geometry & MOs

Info

ID:	343013
PubChem CID:	127266176
Reduced:	N3O3C19H31 (1)
Stoich.:	A3B3C19D31 (1)
Weight, g/mol:	312.12407
ΔH_f, kcal/mol:	-139.36
Dipole, Da:	5.75
IP(EA), eV:	-8.94(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-chloro-5-[(4-hydroxy-2,6-dimethylpiperidin-1-yl)methyl]pyridine-3-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCC(CC1)N(CCCO)CC2=CC=CC=N2

DOS

IR

Vibrations