Geometry & MOs

Info

ID:	381095
PubChem CID:	134971737
Reduced:	SiN2O5C27H30 (1)
Stoich.:	AB2C5D27E30 (1)
Weight, g/mol:	336.09662
ΔH_f, kcal/mol:	-144.3
Dipole, Da:	3.48
IP(EA), eV:	-9.06(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E,3R,4S)-4-hydroxy-3-methyl-6-[2-(2-propan-2-yl-1,3-thiazol-4-yl)-1,3-thiazol-4-yl]hex-5-en-2-one

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C1=CC=CC=C1)(C2=CC=CC=C2)OCCCC3=NC(=CO3)C4=NC(=CO4)C(=O)OC

DOS

IR

Vibrations