Geometry & MOs

Info

ID:

146536

PubChem CID:

53702132

Reduced:

C17H28 (1)

Stoich.:

A17B28 (1)

Weight, g/mol:

1342.882797

ΔHf, kcal/mol:

-34.74

Dipole, Da:

0.99

IP(EA), eV:

-9.01(0.55)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

dodecyl 3-ethyl-1,6-dimethylpyrazolo[5,1-c][1,2,4]triazole-7-carboxylate;7-ethyl-1,6-dimethyl-2-(4-nitrophenyl)pyrazolo[1,5-b][1,2,4]triazole;N-[4-(7-ethyl-1,6-dimethylpyrazolo[5,1-c][1,2,4]triazol-3-yl)phenyl]hexadecane-1-sulfonamide;4-ethyl-1,2,5-trimethylimidazole

Drug info:

PubChemData

Smile

CCCCCCCC1=CC=CC=C1CCCC

DOS

IR

Vibrations