Geometry & MOs

Info

ID:	283300
PubChem CID:	103972301
Reduced:	O2N3C12H21 (1)
Stoich.:	A2B3C12D21 (1)
Weight, g/mol:	243.056529
ΔH_f, kcal/mol:	-40.28
Dipole, Da:	3.42
IP(EA), eV:	-9.02(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl 2-[(2-methyl-1,3-thiazol-4-yl)methyl]propanedioate

Drug info:

PubChemData

Smile

CC(C)OCC1=NC(=NO1)C2CCCCCN2

DOS

IR

Vibrations