Geometry & MOs

Info

ID:	21975
PubChem CID:	594487
Reduced:	OCl5C18H27 (1)
Stoich.:	AB5C18D27 (1)
Weight, g/mol:	436.047504
ΔH_f, kcal/mol:	-68.6
Dipole, Da:	5.97
IP(EA), eV:	-8.87(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

chloromethane;phenoxymethylbenzene

Drug info:

PubChemData

Smile

CCl.CCl.CCl.CCl.CCl.C1=CC=C(C=C1)COC2=CC=CC=C2

DOS

IR

Vibrations