Geometry & MOs

Info

ID:

81198

PubChem CID:

49854455

Reduced:

SN7O10C37H49 (1)

Stoich.:

AB7C10D37E49 (1)

Weight, g/mol:

476.151826

ΔHf, kcal/mol:

-364.54

Dipole, Da:

9.49

IP(EA), eV:

 -9.42(-1.24)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

3-(cyclopentylmethoxy)-5-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenoxy]-N-(1,3-thiazol-2-yl)benzamide

Drug info:

PubChemData

Smile

C1CN(CCN(CCN(CCN1CC(=O)N[C@@H](CC2=CC3=CC=CC=C3C=C2)C(=O)NCCC4=CC=C(C=C4)S(=O)(=O)N)CC(=O)O)CC(=O)O)CC(=O)O

DOS

IR

Vibrations