Geometry & MOs

Info

ID:	28725
PubChem CID:	829196
Reduced:	N2O5C9H14 (1)
Stoich.:	A2B5C9D14 (1)
Weight, g/mol:	287.05422
ΔH_f, kcal/mol:	-221.22
Dipole, Da:	1.8
IP(EA), eV:	-9.97(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,9S)-1,9-dihydroxy-4,6,8-triazatetracyclo[7.7.0.02,7.010,15]hexadeca-2(7),10,12,14-tetraene-3,5,16-trione

Drug info:

PubChemData

Smile

CC(=O)O[C@@H]1[C@H](N(C(=O)N1C)C)OC(=O)C

DOS

IR

Vibrations