Geometry & MOs

Info

ID:	147376
PubChem CID:	53787032
Reduced:	N4O5C15H18 (1)
Stoich.:	A4B5C15D18 (1)
Weight, g/mol:	278.141913
ΔH_f, kcal/mol:	-133.75
Dipole, Da:	6.14
IP(EA), eV:	-8.53(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(1-pyridin-3-ylbut-1-en-2-yl)-3,4-dihydro-1H-quinolin-2-one

Drug info:

PubChemData

Smile

CC1=C(C(=C2C(=COC(=O)N)[C@@]3([C@H]4[C@H](N4)CN3C2=C1O)OC)O)N

DOS

IR

Vibrations