Geometry & MOs

Info

ID:	434798
PubChem CID:	135175724
Reduced:	NS2O3C12H25 (1)
Stoich.:	AB2C3D12E25 (1)
Weight, g/mol:	710.214126
ΔH_f, kcal/mol:	-142.02
Dipole, Da:	3.39
IP(EA), eV:	-9.01(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-[4-(4-chlorophenyl)phenyl]-2-[(6-cyclopentyloxynaphthalen-2-yl)sulfonylamino]-3,3-difluoropropanoyl]-N'-hydroxypiperidine-4-carboximidamide

Drug info:

PubChemData

Smile

CC(C(=O)COCCOCCCN(C)C(C)S)S

DOS

IR

Vibrations