Geometry & MOs

Info

ID:

434558

PubChem CID:

135175204

Reduced:

F2N2O3C30H38 (1)

Stoich.:

A2B2C3D30E38 (1)

Weight, g/mol:

621.187576

ΔHf, kcal/mol:

-217.64

Dipole, Da:

2.6

IP(EA), eV:

 -9.25(0.0)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[(2R)-3-(4-aminopiperidin-1-yl)-1-(4-chloro-3-methoxyphenyl)-1,1-difluoro-3-oxopropan-2-yl]-6-cyclopentyloxynaphthalene-2-sulfonamide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NC1CC2CCC(C1)C2C(=O)C(C(C3=CC=C(C=C3)C4=CC=CC=C4)(F)F)N(C)C

DOS

IR

Vibrations