Geometry & MOs

Info

ID:	383343
PubChem CID:	134975014
Reduced:	N4O4C27H38 (1)
Stoich.:	A4B4C27D38 (1)
Weight, g/mol:	212.068473
ΔH_f, kcal/mol:	-132.41
Dipole, Da:	7.41
IP(EA), eV:	-8.94(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R,3S)-3-acetyloxy-7-oxabicyclo[2.2.1]hept-5-en-2-yl] acetate

Drug info:

PubChemData

Smile

CC1=CC(=O)OC2=C(C3=C(C=C12)C(=C(O3)C)/C=C/C(=O)NCCCNCCCCNCCCN)C

DOS

IR

Vibrations