Geometry & MOs

Info

ID:	434584
PubChem CID:	135175259
Reduced:	ON6C14H22 (1)
Stoich.:	AB6C14D22 (1)
Weight, g/mol:	691.15271
ΔH_f, kcal/mol:	20.19
Dipole, Da:	4.86
IP(EA), eV:	-8.42(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2S)-3-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)-1-(4-bromo-3-methoxyphenyl)-1,1-difluoro-3-oxopropan-2-yl]-6-cyclopentyloxynaphthalene-2-sulfonamide

Drug info:

PubChemData

Smile

CN1C2=CC(=NC=C2N=C1COCCN3CCNCC3)N

DOS

IR

Vibrations