Geometry & MOs

Info

ID:	407113
PubChem CID:	135079351
Reduced:	NOC6H7 (2)
Stoich.:	ABC6D7 (2)
Weight, g/mol:	219.113353
ΔH_f, kcal/mol:	-13.19
Dipole, Da:	3.7
IP(EA), eV:	-9.16(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

(E)-1-hydroxy-1-(2-propan-2-yloxyphenyl)prop-1-ene-2-diazonium

Drug info:

PubChemData

Smile

CC(C)OC1=CC=CC=C1/C(=C(/C)\[N+]#N)/[O-]

DOS

IR

Vibrations