Geometry & MOs

Info

ID:	313273
PubChem CID:	126613225
Reduced:	N2O2C13H14 (1)
Stoich.:	A2B2C13D14 (1)
Weight, g/mol:	386.195405
ΔH_f, kcal/mol:	5.53
Dipole, Da:	0.78
IP(EA), eV:	-9.63(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3S,3aR,6S,6aS)-6-imidazo[1,2-a]pyridin-8-yloxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl]-3-cyclohexylurea

Drug info:

PubChemData

Smile

C1[C@@H]([C@@H]2[C@H](O1)[C@H](CO2)N)C#CC3=CC=CC=N3

DOS

IR

Vibrations