Geometry & MOs

Info

ID:	51188
PubChem CID:	12013823
Reduced:	O2H10C11 (1)
Stoich.:	A2B10C11 (1)
Weight, g/mol:	168.089878
ΔH_f, kcal/mol:	-35.02
Dipole, Da:	4.88
IP(EA), eV:	-9.72(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-2-diazonio-1-[(E)-4-methylpent-2-enoxy]ethenolate

Drug info:

PubChemData

Smile

C1[C@@H]2[C@@H]([C@@H]2C(=O)O1)C3=CC=CC=C3

DOS

IR

Vibrations