Geometry & MOs

Info

ID:	185561
PubChem CID:	77314504
Reduced:	SN7C12H17 (1)
Stoich.:	AB7C12D17 (1)
Weight, g/mol:	303.151767
ΔH_f, kcal/mol:	79.54
Dipole, Da:	1.51
IP(EA), eV:	-7.73(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[amino-(4-methyl-3H-1,3-thiazol-2-ylidene)methyl]-N-cyclohexylpyrimidin-2-amine

Drug info:

PubChemData

Smile

CC1=CSC(=C(C2=NC(=NC(=N2)NC3CC3)NC)N)N1

DOS

IR

Vibrations