Geometry & MOs

Info

ID:

259654

PubChem CID:

103170612

Reduced:

N3C16H21 (1)

Stoich.:

A3B16C21 (1)

Weight, g/mol:

314.187339

ΔHf, kcal/mol:

54.02

Dipole, Da:

3.45

IP(EA), eV:

-8.72(-0.6)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

[1-(4-chloro-2-ethyl-5-methylpyrazol-3-yl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine

Drug info:

PubChemData

Smile

C1CC(C1)CC(CC2=CC=NC3=CC=CC=C23)NN

DOS

IR

Vibrations