Geometry & MOs

Info

ID:	299191
PubChem CID:	117676921
Reduced:	O3N6C32H36 (1)
Stoich.:	A3B6C32D36 (1)
Weight, g/mol:	152.068473
ΔH_f, kcal/mol:	14.32
Dipole, Da:	7.6
IP(EA), eV:	-8.81(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,2-dimethoxypropane-1,2,3-triol

Drug info:

PubChemData

Smile

C1CCN(C1)CC#CC(=O)N2CCC(CC2)[C@@H]3CCN=C4N3NC(=C4C(=O)N)C5=CC=C(C=C5)OC6=CC=CC=C6

DOS

IR

Vibrations