Geometry & MOs

Info

ID:	25867
PubChem CID:	632168
Reduced:	NO5C25H39 (1)
Stoich.:	AB5C25D39 (1)
Weight, g/mol:	358.120509
ΔH_f, kcal/mol:	-237.65
Dipole, Da:	3.33
IP(EA), eV:	-9.68(0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-ethoxy-1-methoxynaphthalen-2-yl)naphthalene-1,4-dione

Drug info:

PubChemData

Smile

CC1C2CCC3C4CCC(=NO)C4(CCC3C2(C(C5C1OC(O5)(C)C)OC(=O)C)C)C

DOS

IR

Vibrations