Geometry & MOs

Info

ID:	292130
PubChem CID:	114465381
Reduced:	SN2O6C12H16 (1)
Stoich.:	AB2C6D12E16 (1)
Weight, g/mol:	257.152812
ΔH_f, kcal/mol:	-236.88
Dipole, Da:	4.91
IP(EA), eV:	-9.42(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-[2-(2-methylprop-2-enoxy)ethyl]quinoline-4,8-diamine

Drug info:

PubChemData

Smile

CC(C)OC(=O)NS(=O)(=O)NC1=CC=CC(=C1)C(=O)OC

DOS

IR

Vibrations