Geometry & MOs

Info

ID:	148953
PubChem CID:	53788623
Reduced:	SN3O4C25H31 (1)
Stoich.:	AB3C4D25E31 (1)
Weight, g/mol:	192.099774
ΔH_f, kcal/mol:	-83.87
Dipole, Da:	2.87
IP(EA), eV:	-8.53(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3R,4R,5R,6R)-2,4-dimethoxy-6-methyloxane-3,5-diol

Drug info:

PubChemData

Smile

CC(=CC1=CC=C(C=C1)OC)CN(C)CCN(CCO)S(=O)(=O)C2=CC=CC3=C2C=CN=C3

DOS

IR

Vibrations