Geometry & MOs

Info

ID:	208703
PubChem CID:	80569005
Reduced:	NOSC6H7 (2)
Stoich.:	ABCD6E7 (2)
Weight, g/mol:	240.093249
ΔH_f, kcal/mol:	-32.97
Dipole, Da:	6.5
IP(EA), eV:	-9.3(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1-methylcyclohexyl)amino]-1,3-thiazole-4-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)C(C1=CC=CS1)NC2=NC(=CS2)C(=O)O

DOS

IR

Vibrations