Geometry & MOs

Info

ID:	381182
PubChem CID:	134971835
Reduced:	N3O6H15C17 (1)
Stoich.:	A3B6C15D17 (1)
Weight, g/mol:	285.136493
ΔH_f, kcal/mol:	-142.1
Dipole, Da:	1.91
IP(EA), eV:	-9.79(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,13R,15R,16R)-15-methyl-5,7-dioxa-12-azapentacyclo[10.6.1.02,10.04,8.013,18]nonadeca-2,4(8),9,17-tetraen-16-ol

Drug info:

PubChemData

Smile

COC(=O)C1=COC(=N1)C2=COC(=N2)CNC(=O)OCC3=CC=CC=C3

DOS

IR

Vibrations