Geometry & MOs

Info

ID:	15475
PubChem CID:	442467
Reduced:	NO2C16H25 (1)
Stoich.:	AB2C16D25 (1)
Weight, g/mol:	263.188529
ΔH_f, kcal/mol:	-111.21
Dipole, Da:	4.8
IP(EA), eV:	-8.78(0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,2R,10S,11R,13R,15R)-11-hydroxy-15-methyl-6-azatetracyclo[8.6.0.01,6.02,13]hexadecan-14-one

Drug info:

PubChemData

Smile

C[C@@H]1C[C@]23[C@@H]4CCCN2CCC[C@@H]3[C@@H](C[C@H]4C1=O)O

DOS

IR

Vibrations