Geometry & MOs

Info

ID:	402828
PubChem CID:	135057436
Reduced:	N2O3H24C27 (1)
Stoich.:	A2B3C24D27 (1)
Weight, g/mol:	278.110693
ΔH_f, kcal/mol:	-39.37
Dipole, Da:	5.26
IP(EA), eV:	-8.74(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(3-fluorophenyl)ethyl]naphthalene-1-carbaldehyde

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)CCC(=O)C2=CC=C(C=C2)OC)C(=O)NC3=CC=CC4=C3N=CC=C4

DOS

IR

Vibrations