Geometry & MOs

Info

ID:

187284

PubChem CID:

77553939

Reduced:

FO2N3H30C32 (1)

Stoich.:

AB2C3D30E32 (1)

Weight, g/mol:

475.263506

ΔHf, kcal/mol:

-24.61

Dipole, Da:

7.83

IP(EA), eV:

 -8.8(-0.55)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[[2-[1-(4-fluorophenyl)-4-methyl-5,6,7,8-tetrahydro-4H-cyclopenta[f]indazol-5-yl]-1-phenylethyl]-(2-hydroxyethyl)amino]ethanol

Drug info:

PubChemData

Smile

CC1C2=C(CC3=C1C(CC3)CC(C4=CC=CC=C4)NC(=O)C5=CC=CC=C5O)N(N=C2)C6=CC=C(C=C6)F

DOS

IR

Vibrations