Geometry & MOs

Info

ID:	391896
PubChem CID:	135010710
Reduced:	ON4C19H21 (2)
Stoich.:	AB4C19D21 (2)
Weight, g/mol:	190.120509
ΔH_f, kcal/mol:	84.74
Dipole, Da:	2.76
IP(EA), eV:	-8.03(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S,5S)-4-methoxy-5-[(1R)-1-methoxyethyl]-2,2-dimethyl-1,3-dioxolane

Drug info:

PubChemData

Smile

C1=CC2=C(C(=C1)NCC3=CC=CC(=N3)CNCCOCCOCCNCC4=NC(=CC=C4)CNC5=CC=CC6=C5N=CC=C6)N=CC=C2

DOS

IR

Vibrations