Geometry & MOs

Info

ID:	322172
PubChem CID:	126669056
Reduced:	CClNH2 (2)
Stoich.:	ABCD2 (2)
Weight, g/mol:	462.05864
ΔH_f, kcal/mol:	26.4
Dipole, Da:	2.76
IP(EA), eV:	-9.69(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-[4-(2-ethyltetrazol-5-yl)phenoxy]-3,3-dimethylpentoxy] thiohypoiodite

Drug info:

PubChemData

Smile

[C@H]1(C(NN1)Cl)Cl

DOS

IR

Vibrations