Geometry & MOs

Info

ID:	236480
PubChem CID:	92713403
Reduced:	NO2C11H15 (2)
Stoich.:	AB2C11D15 (2)
Weight, g/mol:	462.19215
ΔH_f, kcal/mol:	-140.34
Dipole, Da:	4.77
IP(EA), eV:	-8.15(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 1-[(S)-(3-chlorophenyl)-[4-hydroxy-1-(2-methoxyethyl)-6-methyl-2-oxopyridin-3-yl]methyl]piperidine-4-carboxylate

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=O)N1CCOC)[C@H](C2=CC=CC=C2OC)N3CCCCC3)O

DOS

IR

Vibrations