Geometry & MOs

Info

ID:	52775
PubChem CID:	12015937
Reduced:	NPO5C7H12 (1)
Stoich.:	ABC5D7E12 (1)
Weight, g/mol:	233.069119
ΔH_f, kcal/mol:	-260.47
Dipole, Da:	5.84
IP(EA), eV:	-10.24(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

(1Z,5E)-6-dimethoxyphosphoryl-2-hydroxyhexa-1,5-diene-1-diazonium

Drug info:

PubChemData

Smile

C1C[C@H](C(=C1)P(=O)(O)O)[C@H](C(=O)O)N

DOS

IR

Vibrations