Geometry & MOs

Info

ID:	45635
PubChem CID:	10515879
Reduced:	N2O4C13H18 (1)
Stoich.:	A2B4C13D18 (1)
Weight, g/mol:	266.126657
ΔH_f, kcal/mol:	-124.43
Dipole, Da:	4.18
IP(EA), eV:	-9.66(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-butyl-9-ethyl-3,7-diazabicyclo[3.3.1]nonane-2,4,6,8-tetrone

Drug info:

PubChemData

Smile

C[C@@H](C(=O)N(C)OC)NC(=O)OCC1=CC=CC=C1

DOS

IR

Vibrations