Geometry & MOs

Info

ID:

346431

PubChem CID:

127270935

Reduced:

O2F3N3C19H26 (1)

Stoich.:

A2B3C3D19E26 (1)

Weight, g/mol:

301.179027

ΔHf, kcal/mol:

-263.15

Dipole, Da:

5.47

IP(EA), eV:

-9.36(-0.1)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

N-(2-cyclohexyloxyethyl)-5-methyl-1H-indazole-7-carboxamide

Drug info:

PubChemData

Smile

CC1=C(NC2=C1C(=O)CC(C2)(C)C)C(=O)NCC3CCN(C3)CC(F)(F)F

DOS

IR

Vibrations