Geometry & MOs

Info

ID:	398504
PubChem CID:	135033539
Reduced:	OSiN3C24H31 (1)
Stoich.:	ABC3D24E31 (1)
Weight, g/mol:	433.218554
ΔH_f, kcal/mol:	41.75
Dipole, Da:	3.17
IP(EA), eV:	-8.21(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 1-pyrimidin-2-yl-2-[2-tri(propan-2-yl)silylethynyl]indole-4-carboxylate

Drug info:

PubChemData

Smile

CC(C)[Si](C#CC1=CC2=C(N1C3=NC=CC=N3)C=CC(=C2)OC)(C(C)C)C(C)C

DOS

IR

Vibrations