Geometry & MOs

Info

ID:	160625
PubChem CID:	57389252
Reduced:	NO2C10H15 (2)
Stoich.:	AB2C10D15 (2)
Weight, g/mol:	299.077004
ΔH_f, kcal/mol:	-88.41
Dipole, Da:	12.84
IP(EA), eV:	-9.23(-2.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-acetamido-2,3,5-trihydroxycyclohexyl)methyl dihydrogen phosphate

Drug info:

PubChemData

Smile

C/C(=C\C=C\C=C(\C=C\C=C(\C(=O)[O-])/C)/C)/C=C/C=C(/C(=O)[O-])\C.[NH4+].[NH4+]

DOS

IR

Vibrations