Geometry & MOs

Info

ID:	293095
PubChem CID:	117373758
Reduced:	O3C15H20 (1)
Stoich.:	A3B15C20 (1)
Weight, g/mol:	248.141244
ΔH_f, kcal/mol:	-128.93
Dipole, Da:	5.25
IP(EA), eV:	-8.69(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-methoxy-5-(oxan-4-yl)phenyl]cyclopropan-1-ol

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)C2CCCC2)CCC(=O)O

DOS

IR

Vibrations