Geometry & MOs

Info

ID:	390616
PubChem CID:	135000004
Reduced:	NSSiO7C24H35 (1)
Stoich.:	ABCD7E24F35 (1)
Weight, g/mol:	289.052112
ΔH_f, kcal/mol:	-335.75
Dipole, Da:	1.59
IP(EA), eV:	-8.9(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[(4-cyano-3-oxo-1,2-thiazol-5-yl)amino]-5-methylbenzoate

Drug info:

PubChemData

Smile

CCOC(=O)C(C=CCC[Si](OC)(OC)OC)C1=C(CN(C1)S(=O)(=O)C2=CC=C(C=C2)C)C=C

DOS

IR

Vibrations