Geometry & MOs

Info

ID:	173861
PubChem CID:	75691310
Reduced:	SN2O3C19H22 (1)
Stoich.:	AB2C3D19E22 (1)
Weight, g/mol:	310.044585
ΔH_f, kcal/mol:	-98.76
Dipole, Da:	5.06
IP(EA), eV:	-9.13(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-oxo-1-(thiophen-2-ylmethylamino)propan-2-yl] 4-methyl-1,3-thiazole-5-carboxylate

Drug info:

PubChemData

Smile

CC1=C(SC=N1)C(=O)OCC(=O)NC(C)C2=CC3=C(CCCC3)C=C2

DOS

IR

Vibrations