Geometry & MOs

Info

ID:	392955
PubChem CID:	135018692
Reduced:	SO3H12C18 (1)
Stoich.:	AB3C12D18 (1)
Weight, g/mol:	381.157623
ΔH_f, kcal/mol:	-33.7
Dipole, Da:	4.74
IP(EA), eV:	-8.06(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9H-fluoren-9-ylmethyl N-[(4-methyl-2,6,7-trioxabicyclo[2.2.2]octan-1-yl)methyl]carbamate

Drug info:

PubChemData

Smile

C1/C(=C/SC2=CC=CC=C2)/C3=C(O1)C4=CC=CC=C4OC3=O

DOS

IR

Vibrations