Geometry & MOs

Info

ID:	256950
PubChem CID:	103142612
Reduced:	ClO2C16H23 (1)
Stoich.:	AB2C16D23 (1)
Weight, g/mol:	286.09323
ΔH_f, kcal/mol:	-99.94
Dipole, Da:	4.61
IP(EA), eV:	-8.86(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-(bromomethyl)-2-bicyclo[2.2.1]heptanyl]methyl]-5-methyloxolane

Drug info:

PubChemData

Smile

CC1CCC(O1)CC(CC2=CC(=CC=C2)OC)CCl

DOS

IR

Vibrations