Geometry & MOs

Info

ID:

150804

PubChem CID:

53790500

Reduced:

SCl2N13O14C115H121 (1)

Stoich.:

AB2C13D14E115F121 (1)

Weight, g/mol:

326.082205

ΔHf, kcal/mol:

76.36

Dipole, Da:

3.35

IP(EA), eV:

 -8.12(-1.36)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(5-chloro-2-methoxyphenyl)-(2-methoxynaphthalen-1-yl)diazene

Drug info:

PubChemData

Smile

CC.CC.CC.CC.CC.CC1=CC(=C(C=C1)OC)N=NC2=C(C=CC3=CC=CC=C32)OC.COC1=C(C=C(C=C1)SOON)N=NC2=C(C=CC3=CC=CC=C32)OC.COC1=C(C=C(C=C1)Cl)N=NC2=C(C=CC3=CC=CC=C32)OC.COC1=C(C=C(C=C1)Cl)N=NC2=C(C(=CC3=CC=CC=C32)C(=O)NC4=CC=CC=C4)OC.COC1=CC=CC=C1N=NC2=C(C(=CC3=CC=CC=C32)C(=O)NC4=CC=CC=C4)OC

DOS

IR

Vibrations