Geometry & MOs

Info

ID:	402924
PubChem CID:	135057891
Reduced:	N3C12H13 (1)
Stoich.:	A3B12C13 (1)
Weight, g/mol:	259.985091
ΔH_f, kcal/mol:	88.69
Dipole, Da:	4.44
IP(EA), eV:	-9.29(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	-2

Chem-info

IUPAC name:

[3-methylbut-3-enoxy(oxido)phosphoryl]oxy hydrogen phosphate

Drug info:

PubChemData

Smile

CC(=C)C1=CN(N=N1)CC2=CC=CC=C2

DOS

IR

Vibrations