Geometry & MOs

Info

ID:	324129
PubChem CID:	126676975
Reduced:	N7C22H23 (1)
Stoich.:	A7B22C23 (1)
Weight, g/mol:	166.003286
ΔH_f, kcal/mol:	133.72
Dipole, Da:	4.11
IP(EA), eV:	-8.44(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R,5R)-3-chloro-4-hydroxy-5-(hydroxymethyl)oxolan-2-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CC2=CC(=CC=C2)N3C=C(C=N3)CC4=CC(=NC(=C4N)NN)N

DOS

IR

Vibrations