Geometry & MOs

Info

ID:	49804
PubChem CID:	11533848
Reduced:	NCl3O6C23H38 (1)
Stoich.:	AB3C6D23E38 (1)
Weight, g/mol:	530.203982
ΔH_f, kcal/mol:	-345.27
Dipole, Da:	2.95
IP(EA), eV:	-9.79(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCC[C@@H]1C[C@H]([C@@H](N([C@@H]1C(=O)OC)C(=O)OCC(Cl)(Cl)Cl)CCCOC2CCCCO2)CC

DOS

IR

Vibrations