Geometry & MOs

Info

ID:	127724
PubChem CID:	51012812
Reduced:	NO3C19H25 (1)
Stoich.:	AB3C19D25 (1)
Weight, g/mol:	336.132136
ΔH_f, kcal/mol:	-117.62
Dipole, Da:	5.04
IP(EA), eV:	-9.18(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,8S,9S)-9-hydroxy-4,8-dimethoxy-5,11,13-trimethyl-11,13-diazatricyclo[7.3.1.02,7]trideca-2(7),4-diene-3,6,10-trione

Drug info:

PubChemData

Smile

C[C@H](C(=O)N1[C@@H]2CC[C@](C1=O)(C2(C)C)C)OCC3=CC=CC=C3

DOS

IR

Vibrations