Geometry & MOs

Info

ID:	398684
PubChem CID:	135034806
Reduced:	FNSiO2C32H38 (1)
Stoich.:	ABCD2E32F38 (1)
Weight, g/mol:	472.292133
ΔH_f, kcal/mol:	-138.38
Dipole, Da:	2.34
IP(EA), eV:	-8.87(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[tert-butyl(dimethyl)silyl]oxy-5,5-dimethyloct-7-en-1-ynyl]-5-fluoro-6-piperidin-1-ylpyridine-3-carbaldehyde

Drug info:

PubChemData

Smile

CC1(C[C@@]2(CC3=NC(=C(C=C3C=C2)F)C4=CC5=CC=CC=C5C=C4)C(=O)CC1O[Si](C)(C)C(C)(C)C)C

DOS

IR

Vibrations