Geometry & MOs

Info

ID:	206870
PubChem CID:	80314618
Reduced:	SN2O2C15H18 (1)
Stoich.:	AB2C2D15E18 (1)
Weight, g/mol:	239.098
ΔH_f, kcal/mol:	-44.9
Dipole, Da:	3.98
IP(EA), eV:	-8.59(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4-methyl-1,3-thiazol-2-yl)methyl]cyclohexane-1-carboxylic acid

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N(CCC(=O)O)CC2=NC(=CS2)C

DOS

IR

Vibrations