Geometry & MOs

Info

ID:	293893
PubChem CID:	117410627
Reduced:	O3C16H22 (1)
Stoich.:	A3B16C22 (1)
Weight, g/mol:	262.156895
ΔH_f, kcal/mol:	-138.18
Dipole, Da:	4.54
IP(EA), eV:	-9.42(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC1=C(C=CC(=C1C)C)C2(CCCC2)C(=O)O

DOS

IR

Vibrations