Geometry & MOs

Info

ID:	382438
PubChem CID:	134973583
Reduced:	NO4C21H29 (1)
Stoich.:	AB4C21D29 (1)
Weight, g/mol:	557.2596
ΔH_f, kcal/mol:	-170.25
Dipole, Da:	3.6
IP(EA), eV:	-9.83(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-bis[4-(2,5-dimethylpyrrol-1-yl)phenyl]phosphorylphenyl]-2,5-dimethylpyrrole

Drug info:

PubChemData

Smile

CCN(CC)C(=O)OC1=C(C(=O)C2=CC=CC=C2C1(CCC(C)C)O)C

DOS

IR

Vibrations