Geometry & MOs

Info

ID:	178402
PubChem CID:	76323231
Reduced:	O3N5H15C16 (1)
Stoich.:	A3B5C15D16 (1)
Weight, g/mol:	240.172545
ΔH_f, kcal/mol:	85.32
Dipole, Da:	8.53
IP(EA), eV:	-9.04(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3aR,6aS)-2-cyclohexyl-5-ethoxy-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CCNC(=O)N/N=C/C2=CC3=NO[N+](=C3C=C2)[O-]

DOS

IR

Vibrations