Geometry & MOs

Info

ID:	405722
PubChem CID:	135075159
Reduced:	O5C29H48 (1)
Stoich.:	A5B29C48 (1)
Weight, g/mol:	251.951163
ΔH_f, kcal/mol:	-210.47
Dipole, Da:	1.8
IP(EA), eV:	-9.45(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methoxy-4-(1,2,2-trichloroethenoxy)benzene

Drug info:

PubChemData

Smile

CCCCCCCCOC(CC[C@@H]1[C@H](O1)CC[C@H]2[C@@H](O2)COC(C)OCC)CC3=CC=CC=C3

DOS

IR

Vibrations