Geometry & MOs

Info

ID:	200015
PubChem CID:	79331674
Reduced:	NOC12H15 (1)
Stoich.:	ABC12D15 (1)
Weight, g/mol:	232.14633
ΔH_f, kcal/mol:	-7.89
Dipole, Da:	3.7
IP(EA), eV:	-9.86(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[2-(3-methylphenoxy)ethyl]bicyclo[3.1.0]hexan-6-ol

Drug info:

PubChemData

Smile

C1CC2C(C1)C2(CC3=CC=NC=C3)O

DOS

IR

Vibrations