Geometry & MOs

Info

ID:	403016
PubChem CID:	135058336
Reduced:	SN2O5H14C16 (1)
Stoich.:	AB2C5D14E16 (1)
Weight, g/mol:	355.231874
ΔH_f, kcal/mol:	-82.39
Dipole, Da:	5.36
IP(EA), eV:	-9.41(-1.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-methoxypentyl)-8-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)quinoline

Drug info:

PubChemData

Smile

CC1(C2=CC=CC=C2N(C1=O)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])C

DOS

IR

Vibrations