Geometry & MOs

Info

ID:	372794
PubChem CID:	131304924
Reduced:	O2S2H10C11 (1)
Stoich.:	A2B2C10D11 (1)
Weight, g/mol:	221.073774
ΔH_f, kcal/mol:	-52.17
Dipole, Da:	4.58
IP(EA), eV:	-8.91(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

1-(4,4-difluoro-1-hydroxycyclohexyl)-2,2-dihydroxyethenediazonium

Drug info:

PubChemData

Smile

CC1=CC(=C(C2=C1SC=C2)SC)C(=O)O

DOS

IR

Vibrations