Geometry & MOs

Info

ID:	198568
PubChem CID:	79119774
Reduced:	NOC13H25 (1)
Stoich.:	ABC13D25 (1)
Weight, g/mol:	266.145285
ΔH_f, kcal/mol:	-78.19
Dipole, Da:	3.48
IP(EA), eV:	-8.76(0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[methyl-[(2-propyl-1,3-thiazol-4-yl)methyl]amino]cyclohexan-1-one

Drug info:

PubChemData

Smile

CCCC(C)CN(C)C1CCC(=O)CC1

DOS

IR

Vibrations