Geometry & MOs

Info

ID:	201515
PubChem CID:	79550111
Reduced:	ClO2C17H23 (1)
Stoich.:	AB2C17D23 (1)
Weight, g/mol:	310.125506
ΔH_f, kcal/mol:	-94.3
Dipole, Da:	1.98
IP(EA), eV:	-9.56(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-benzyl-3-chloro-2-(chloromethyl)propyl]bicyclo[2.2.1]heptane

Drug info:

PubChemData

Smile

C1CC2CC1CC2CC(CO)(CO)C3=CC=C(C=C3)Cl

DOS

IR

Vibrations