Geometry & MOs

Info

ID:	316116
PubChem CID:	126630107
Reduced:	N2O3C11H22 (1)
Stoich.:	A2B3C11D22 (1)
Weight, g/mol:	403.199488
ΔH_f, kcal/mol:	-161.65
Dipole, Da:	4.5
IP(EA), eV:	-9.49(1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(E)-2-[(3Z,5E,7Z)-9-[(1R)-1-acetyloxyethyl]-2-methyl-2H-azonin-3-yl]ethenyl]-2,2-dimethyl-1,3-dioxane-5-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)(C)C(=O)NCCOCCC(=O)NC

DOS

IR

Vibrations