Geometry & MOs

Info

ID:	406323
PubChem CID:	135077247
Reduced:	O2C17H22 (1)
Stoich.:	A2B17C22 (1)
Weight, g/mol:	272.141245
ΔH_f, kcal/mol:	-39.71
Dipole, Da:	4.35
IP(EA), eV:	-9.4(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCC(=O)C=C=CCCCCOCC1=CC=CC=C1

DOS

IR

Vibrations