Geometry & MOs

Info

ID:	371928
PubChem CID:	131280586
Reduced:	SO2F4H6C8 (1)
Stoich.:	AB2C4D6E8 (1)
Weight, g/mol:	208.084792
ΔH_f, kcal/mol:	-268.1
Dipole, Da:	1.46
IP(EA), eV:	-8.98(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3R)-3-amino-7-nitro-2,3-dihydro-1H-inden-5-yl]methanol

Drug info:

PubChemData

Smile

CSC1=C(C=C(C(=C1)O)OC(F)(F)F)F

DOS

IR

Vibrations