Geometry & MOs

Info

ID:	169250
PubChem CID:	75079754
Reduced:	O3C15H28 (1)
Stoich.:	A3B15C28 (1)
Weight, g/mol:	234.125594
ΔH_f, kcal/mol:	-158.16
Dipole, Da:	2.04
IP(EA), eV:	-9.44(0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-(phenylmethoxymethyl)oxepan-2-one

Drug info:

PubChemData

Smile

CCCCCCC1CC=C(C(O1)OCC)OCC

DOS

IR

Vibrations