Geometry & MOs

Info

ID:	256976
PubChem CID:	103142848
Reduced:	N3O3C15H17 (1)
Stoich.:	A3B3C15D17 (1)
Weight, g/mol:	304.079699
ΔH_f, kcal/mol:	-9.41
Dipole, Da:	6.24
IP(EA), eV:	-9.49(-1.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-chloro-2-(chloromethyl)-2-(2-fluorophenyl)propyl]-5-methyloxolane

Drug info:

PubChemData

Smile

C1CC(CNC1)COC2=C3C=NC=CC3=C(C=C2)[N+](=O)[O-]

DOS

IR

Vibrations