Geometry & MOs

Info

ID:	402337
PubChem CID:	135055556
Reduced:	FNS2O3C20H26 (1)
Stoich.:	ABC2D3E20F26 (1)
Weight, g/mol:	284.19476
ΔH_f, kcal/mol:	-137.4
Dipole, Da:	4.97
IP(EA), eV:	-8.2(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-4-phenyl-2-[(1S,2R,3R,5R)-2,6,6-trimethyl-3-bicyclo[3.1.1]heptanyl]-1,3,2-dioxaborolane

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)[C@@](C)(C(F)S(=O)(=O)C2=CC=CC=C2)N[S@](=O)C(C)(C)C

DOS

IR

Vibrations