Geometry & MOs

Info

ID:	339285
PubChem CID:	127261119
Reduced:	N3O4C15H17 (1)
Stoich.:	A3B4C15D17 (1)
Weight, g/mol:	331.153206
ΔH_f, kcal/mol:	-76.69
Dipole, Da:	4.23
IP(EA), eV:	-9.25(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(Z)-(1-amino-2-quinolin-8-yloxyethylidene)amino] 2-butan-2-yloxyacetate

Drug info:

PubChemData

Smile

CC(C)OC(=O)O/N=C(/COC1=CC=CC2=C1N=CC=C2)\N

DOS

IR

Vibrations