Geometry & MOs

Info

ID:	207992
PubChem CID:	80477486
Reduced:	NOSC7H7 (1)
Stoich.:	ABCD7E7 (1)
Weight, g/mol:	231.071785
ΔH_f, kcal/mol:	19.31
Dipole, Da:	1.21
IP(EA), eV:	-9.87(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-thiazol-5-yl-(2,4,5-trimethylphenyl)methanone

Drug info:

PubChemData

Smile

C1CC1C(=O)C2=CN=CS2

DOS

IR

Vibrations