Geometry & MOs

Info

ID:	293106
PubChem CID:	117374029
Reduced:	O3C15H20 (1)
Stoich.:	A3B15C20 (1)
Weight, g/mol:	248.141244
ΔH_f, kcal/mol:	-83.43
Dipole, Da:	1.75
IP(EA), eV:	-8.32(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[3-(oxan-3-yloxy)phenyl]methyl]cyclopropan-1-ol

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)CC2(CC2)O)OC3CCC3

DOS

IR

Vibrations