Geometry & MOs

Info

ID:	46485
PubChem CID:	10524651
Reduced:	ISiO3C14H23 (1)
Stoich.:	ABC3D14E23 (1)
Weight, g/mol:	394.122989
ΔH_f, kcal/mol:	-150.51
Dipole, Da:	3.0
IP(EA), eV:	-9.74(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1,6-diphenylpyrazolo[3,4-d]pyrimidin-4-yl)-(4-fluorophenyl)methanone

Drug info:

PubChemData

Smile

C[Si](C)(C)OCCOC(COCC1=CC=CC=C1)I

DOS

IR

Vibrations