Geometry & MOs

Info

ID:	323945
PubChem CID:	126676652
Reduced:	NO3C12H21 (1)
Stoich.:	AB3C12D21 (1)
Weight, g/mol:	288.104084
ΔH_f, kcal/mol:	-143.66
Dipole, Da:	4.72
IP(EA), eV:	-9.75(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 2-chloro-3-fluoro-2,5,7,8-tetrahydro-1H-1,6-naphthyridine-6-carboxylate

Drug info:

PubChemData

Smile

CC1CC(OC(O1)CNC(=O)C=C)C(C)C

DOS

IR

Vibrations