Geometry & MOs

Info

ID:	216359
PubChem CID:	85086093
Reduced:	O2C17H22 (1)
Stoich.:	A2B17C22 (1)
Weight, g/mol:	258.16198
ΔH_f, kcal/mol:	-87.0
Dipole, Da:	2.59
IP(EA), eV:	-9.29(0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-1-phenyl-4-oxatricyclo[4.3.1.13,8]undecan-5-ol

Drug info:

PubChemData

Smile

CC(=O)OC1C(=CC2=CC=CC=C2)CCCC1(C)C

DOS

IR

Vibrations