Geometry & MOs

Info

ID:

427017

PubChem CID:

135155063

Reduced:

FPN6O7C27H38 (1)

Stoich.:

ABC6D7E27F38 (1)

Weight, g/mol:

635.1265

ΔHf, kcal/mol:

-359.47

Dipole, Da:

4.27

IP(EA), eV:

 -8.83(-1.0)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC(=O)OCC(C)(C)NP(=O)(CO[C@@H](C)CN1C=NC2=C(N=CN=C21)N)OCC3=C(C=C(C=C3)F)C(=O)OC(C)C

DOS

IR

Vibrations