Geometry & MOs

Info

ID:	188975
PubChem CID:	77796033
Reduced:	N2O3C30H34 (1)
Stoich.:	A2B3C30D34 (1)
Weight, g/mol:	471.141482
ΔH_f, kcal/mol:	-47.17
Dipole, Da:	6.24
IP(EA), eV:	-8.47(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

prop-2-enyl 4-[tert-butyl(dimethyl)silyl]oxy-2-[(5-chloroimidazo[5,1-b][1,3]thiazol-2-yl)-hydroxymethyl]pyrrolidine-1-carboxylate

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C=CC(=O)N(C)C2CCC3C4CC5=C(C=CC6=C5C3(C2O6)CCN4CC=C)O

DOS

IR

Vibrations