Geometry & MOs

Info

ID:	427062
PubChem CID:	135155282
Reduced:	NOC5H10 (2)
Stoich.:	ABC5D10 (2)
Weight, g/mol:	743.266363
ΔH_f, kcal/mol:	-89.78
Dipole, Da:	4.11
IP(EA), eV:	-10.64(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2S)-3-(4-aminopiperidin-1-yl)-1-(3-butoxyphenyl)-1,1-difluoro-3-oxopropan-2-yl]-6-cyclopentyloxynaphthalene-2-sulfonamide;2,2,2-trifluoroacetic acid

Drug info:

PubChemData

Smile

CCCC(C)C(C)C.C(=N)=O.C(=N)=O

DOS

IR

Vibrations