Geometry & MOs

Info

ID:	227446
PubChem CID:	87561768
Reduced:	O3C21H38 (1)
Stoich.:	A3B21C38 (1)
Weight, g/mol:	232.918997
ΔH_f, kcal/mol:	-163.54
Dipole, Da:	1.83
IP(EA), eV:	-9.58(0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC[C@@H]1C(O1)CCCC/C=C\CCCCCCCCCC(=O)OC

DOS

IR

Vibrations