Geometry & MOs

Info

ID:	170324
PubChem CID:	75217087
Reduced:	NO8C17H25 (1)
Stoich.:	AB8C17D25 (1)
Weight, g/mol:	389.148595
ΔH_f, kcal/mol:	-350.04
Dipole, Da:	6.69
IP(EA), eV:	-9.59(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-dihydroxybutanedioic acid;2-(3-fluorophenyl)-3,5,5-trimethylmorpholin-2-ol

Drug info:

PubChemData

Smile

CC1C(OCC(N1)(C)C)(C2=CC=CC=C2)O.C(C(C(=O)O)O)(C(=O)O)O

DOS

IR

Vibrations