Geometry & MOs

Info

ID:	126689
PubChem CID:	50973229
Reduced:	FON4C14H17 (1)
Stoich.:	ABC4D14E17 (1)
Weight, g/mol:	363.151767
ΔH_f, kcal/mol:	-41.91
Dipole, Da:	3.09
IP(EA), eV:	-9.56(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-4-[[4-phenyl-5-(1-propan-2-ylpyrazol-4-yl)imidazol-1-yl]methyl]-1,3-thiazole

Drug info:

PubChemData

Smile

CC1=NN(C(=N1)CCCNC(=O)C)C2=CC=C(C=C2)F

DOS

IR

Vibrations