Geometry & MOs

Info

ID:	27359
PubChem CID:	820907
Reduced:	NOC13H14 (1)
Stoich.:	ABC13D14 (1)
Weight, g/mol:	200.08373
ΔH_f, kcal/mol:	10.75
Dipole, Da:	1.8
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.952267
Charge, e:	0

Chem-info

IUPAC name:

1-ethoxynaphthalene-2-carbaldehyde

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)[C@@H](C[N+]2=CC=CC=C2)O

DOS

IR

Vibrations