Geometry & MOs

Info

ID:	406016
PubChem CID:	135076300
Reduced:	N3O3H7C11 (1)
Stoich.:	A3B3C7D11 (1)
Weight, g/mol:	260.120115
ΔH_f, kcal/mol:	-0.71
Dipole, Da:	2.03
IP(EA), eV:	-10.41(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methoxy-1-[(E)-2-phenylethenyl]naphthalene

Drug info:

PubChemData

Smile

COC(=O)/C(=C(\C1=CC=C(C=C1)C#N)/[O-])/[N+]#N

DOS

IR

Vibrations