Geometry & MOs

Info

ID:

434966

PubChem CID:

135176079

Reduced:

F2N3O4C27H39 (1)

Stoich.:

A2B3C4D27E39 (1)

Weight, g/mol:

672.34085

ΔHf, kcal/mol:

-306.48

Dipole, Da:

5.4

IP(EA), eV:

 -8.85(0.24)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[3-[2-(aminomethyl)-8-bicyclo[3.2.1]octanyl]-1-(4-cyclohexyloxyphenyl)-1,1-difluoro-3-oxopropan-2-yl]-4-(cyclohexylmethoxy)benzenesulfonamide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NC1CC2CCC(C1)N2C(=O)C(C(C3=CC=C(C=C3)OC4CCCCC4)(F)F)N

DOS

IR

Vibrations