Geometry & MOs

Info

ID:	433017
PubChem CID:	135173154
Reduced:	SO3N5C20H23 (1)
Stoich.:	AB3C5D20E23 (1)
Weight, g/mol:	217.050395
ΔH_f, kcal/mol:	-40.56
Dipole, Da:	6.58
IP(EA), eV:	-8.87(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-hydroxy-4,6-dimethylpyridin-3-yl)methyl dihydrogen phosphite

Drug info:

PubChemData

Smile

C[C@H]1COCC2=NC3=C(N12)C=C(C=C3)C4=CN=C(N=C4)N5CC[C@H](C5)S(=O)(=O)C

DOS

IR

Vibrations