Geometry & MOs

Info

ID:	46399
PubChem CID:	10524247
Reduced:	Cl2O5C18H20 (1)
Stoich.:	A2B5C18D20 (1)
Weight, g/mol:	386.06419
ΔH_f, kcal/mol:	-175.77
Dipole, Da:	4.23
IP(EA), eV:	-8.63(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2-bromo-1,1,2,2-tetradeuterioethyl)sulfanyl-diphenylmethyl]benzene

Drug info:

PubChemData

Smile

COC1=C(C=C(C(=C1)C(C2=CC(=CC(=C2)Cl)Cl)O)C(OC)OC)OC

DOS

IR

Vibrations