Geometry & MOs

Info

ID:	413405
PubChem CID:	135086354
Reduced:	SiO6C25H40 (1)
Stoich.:	AB6C25D40 (1)
Weight, g/mol:	284.169608
ΔH_f, kcal/mol:	-242.75
Dipole, Da:	15.89
IP(EA), eV:	-8.84(-2.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-3-phenyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole

Drug info:

PubChemData

Smile

CC[Si](CC)(CC)OC1C([C@]23CC(C1OC2=C(C(=O)O3)C(=O)[C@H](C)C[C@H](C)CO)C)C=C

DOS

IR

Vibrations