Geometry & MOs

Info

ID:	412174
PubChem CID:	135085048
Reduced:	O2C11H14 (1)
Stoich.:	A2B11C14 (1)
Weight, g/mol:	204.11503
ΔH_f, kcal/mol:	-69.93
Dipole, Da:	0.79
IP(EA), eV:	-9.25(0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-phenoxycycloheptan-1-one

Drug info:

PubChemData

Smile

C1COCC([C@@H]1C2=CC=CC=C2)O

DOS

IR

Vibrations