Geometry & MOs

Info

ID:

434977

PubChem CID:

135176120

Reduced:

ClSF2N3O4C34H34 (1)

Stoich.:

ABC2D3E4F34G34 (1)

Weight, g/mol:

655.208312

ΔHf, kcal/mol:

-193.14

Dipole, Da:

10.72

IP(EA), eV:

 -9.19(-1.17)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-(3-aminopropyl)-3-[4-(4-chlorophenyl)phenyl]-2-[(6-cyclopentyloxynaphthalen-2-yl)sulfonylamino]-3,3-difluoro-N-methylpropanamide

Drug info:

PubChemData

Smile

C1CCC(C1)OC2=CC3=C(C=C2)C=C(C=C3)S(=O)(=O)NC(C(=O)N4CCNCC4)C(C5=CC=C(C=C5)C6=CC=C(C=C6)Cl)(F)F

DOS

IR

Vibrations