Geometry & MOs

Info

ID:	434579
PubChem CID:	135175254
Reduced:	BrSF2N3O4C29H30 (1)
Stoich.:	ABC2D3E4F29G30 (1)
Weight, g/mol:	282.011743
ΔH_f, kcal/mol:	-176.91
Dipole, Da:	3.04
IP(EA), eV:	-8.98(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-cyclopropyloxynaphthalene-2-sulfonyl chloride

Drug info:

PubChemData

Smile

C1CC1OC2=CC3=C(C=C2)C=C(C=C3)S(=O)(=O)N[C@H](C(=O)N4C5CCC4CC(C5)N)C(C6=CC=C(C=C6)Br)(F)F

DOS

IR

Vibrations