Geometry & MOs

Info

ID:	422364
PubChem CID:	135117697
Reduced:	N2O4C15H24 (1)
Stoich.:	A2B4C15D24 (1)
Weight, g/mol:	439.221954
ΔH_f, kcal/mol:	-132.11
Dipole, Da:	4.65
IP(EA), eV:	-9.52(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,11-dioxa-5,15,16,17,22-pentazapentacyclo[20.2.2.27,10.11,5.115,18]triaconta-7,9,16,18(27),28-pentaene-6,21-dione

Drug info:

PubChemData

Smile

CCOCCC(=O)N1C[C@H]([C@H](C1)OC)CC2=CC(=NO2)C

DOS

IR

Vibrations