Geometry & MOs

Info

ID:	434774
PubChem CID:	135175692
Reduced:	NSO3C16H19 (1)
Stoich.:	ABC3D16E19 (1)
Weight, g/mol:	723.351749
ΔH_f, kcal/mol:	-88.21
Dipole, Da:	6.29
IP(EA), eV:	-9.09(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(3-amino-8-bicyclo[3.2.1]octanyl)-1,1-difluoro-3-oxo-1-[4-(2-piperidin-1-ylethoxy)phenyl]propan-2-yl]-6-cyclopentyloxy-N-methylnaphthalene-2-sulfonamide

Drug info:

PubChemData

Smile

CNS(=O)(=O)C1=CC2=C(C=C1)C=C(C=C2)OC3CCCC3

DOS

IR

Vibrations