Geometry & MOs

Info

ID:	206892
PubChem CID:	80320789
Reduced:	ClNSC10H12 (1)
Stoich.:	ABCD10E12 (1)
Weight, g/mol:	220.10342
ΔH_f, kcal/mol:	13.87
Dipole, Da:	3.08
IP(EA), eV:	-9.3(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CSC(=N1)CC2=CC(CC2)Cl

DOS

IR

Vibrations