Geometry & MOs

Info

ID:	50448
PubChem CID:	12012986
Reduced:	OC8H11 (2)
Stoich.:	AB8C11 (2)
Weight, g/mol:	246.16198
ΔH_f, kcal/mol:	-65.62
Dipole, Da:	2.56
IP(EA), eV:	-9.54(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2R,3R)-3-methyl-2-phenyloxiran-2-yl]cycloheptan-1-ol

Drug info:

PubChemData

Smile

C[C@H]1[C@](O1)(C2=CC=CC=C2)C3(CCCCCC3)O

DOS

IR

Vibrations