Geometry & MOs

Info

ID:	395979
PubChem CID:	135027092
Reduced:	ClN2O4C22H25 (1)
Stoich.:	AB2C4D22E25 (1)
Weight, g/mol:	338.91296
ΔH_f, kcal/mol:	-85.92
Dipole, Da:	4.61
IP(EA), eV:	-9.48(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

benzene;bromopalladium(1+);trimethylphosphanium

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)[C@H]2[C@@H]([C@@H](N[C@@H]2C(=O)OC(C)(C)C)C3=CC=C(C=C3)Cl)[N+](=O)[O-]

DOS

IR

Vibrations