Geometry & MOs

Info

ID:	180038
PubChem CID:	76569487
Reduced:	N4C13H16 (1)
Stoich.:	A4B13C16 (1)
Weight, g/mol:	417.067917
ΔH_f, kcal/mol:	77.09
Dipole, Da:	7.32
IP(EA), eV:	-8.45(0.33)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

1-methyl-3-(3-phenylpyrrol-1-id-2-yl)pyrazole;platinum

Drug info:

PubChemData

Smile

CN1C=C(N=C1)C2C(CNN2)C3=CC=CC=C3

DOS

IR

Vibrations