Geometry & MOs

Info

ID:	78826
PubChem CID:	49737754
Reduced:	OS2N5C15H15 (1)
Stoich.:	AB2C5D15E15 (1)
Weight, g/mol:	417.092932
ΔH_f, kcal/mol:	45.92
Dipole, Da:	4.86
IP(EA), eV:	-8.88(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[2-[[2-[2-[(6-methylpyridin-2-yl)amino]-1,3-thiazol-4-yl]acetyl]amino]-1,3-thiazol-4-yl]acetate

Drug info:

PubChemData

Smile

CC1=NC(=CC=C1)NC2=NC(=CS2)CC(=O)NC3=NC(=CS3)C

DOS

IR

Vibrations