Geometry & MOs

Info

ID:	390771
PubChem CID:	135000846
Reduced:	S2N3O5H7C9 (1)
Stoich.:	A2B3C5D7E9 (1)
Weight, g/mol:	304.93808
ΔH_f, kcal/mol:	-62.1
Dipole, Da:	8.65
IP(EA), eV:	-9.56(-1.68)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

(E)-hex-2-en-1-ol;iodomethane;zinc

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C2=CSC(=N2)NS(=O)(=O)O)[N+](=O)[O-]

DOS

IR

Vibrations