Geometry & MOs

Info

ID:	404656
PubChem CID:	135068696
Reduced:	O3C15H20 (1)
Stoich.:	A3B15C20 (1)
Weight, g/mol:	200.094963
ΔH_f, kcal/mol:	-117.67
Dipole, Da:	5.13
IP(EA), eV:	-8.76(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethoxy-3,4-dihydroquinoline-6-carbonitrile

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C[C@H]2CO[C@@H]3[C@H]2CCCO3

DOS

IR

Vibrations