Geometry & MOs

Info

ID:

87962

PubChem CID:

49899093

Reduced:

ClNSO4H26C31 (1)

Stoich.:

ABCD4E26F31 (1)

Weight, g/mol:

569.125671

ΔHf, kcal/mol:

-71.9

Dipole, Da:

5.2

IP(EA), eV:

 -8.84(-1.38)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[2-methoxy-4-[(Z)-[3-(naphthalen-2-ylmethyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl]phenoxy]-N-(3-nitrophenyl)acetamide

Drug info:

PubChemData

Smile

CCOC1=C(C(=CC(=C1)/C=C\2/C(=O)N(C(=O)S2)CC3=CC=CC4=CC=CC=C43)Cl)OCC5=CC=C(C=C5)C

DOS

IR

Vibrations