Geometry & MOs

Info

ID:	201685
PubChem CID:	79569279
Reduced:	OSN4C15H22 (1)
Stoich.:	ABC4D15E22 (1)
Weight, g/mol:	308.167083
ΔH_f, kcal/mol:	20.81
Dipole, Da:	3.6
IP(EA), eV:	-8.76(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1,5-dimethylpyrazol-4-yl)-(4-propan-2-yl-1,3-thiazol-2-yl)methyl]-2-methoxyethanamine

Drug info:

PubChemData

Smile

CC1=C(C=NN1C)C(C2=NC3=C(S2)CCC3)NCCOC

DOS

IR

Vibrations