Geometry & MOs

Info

ID:	232966
PubChem CID:	87577826
Reduced:	FO2Cl3N3C26H27 (1)
Stoich.:	AB2C3D3E26F27 (1)
Weight, g/mol:	218.188195
ΔH_f, kcal/mol:	-86.8
Dipole, Da:	5.19
IP(EA), eV:	-8.87(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(2-methoxyethoxy)ethoxy]heptane

Drug info:

PubChemData

Smile

C1CN2CCC1[C@@H](C2)N[C@](CC3=C(C=C(C=C3)Cl)F)(C(=O)C4(CC4)C5=C(C=C(C=C5)Cl)Cl)C(=O)N

DOS

IR

Vibrations