Geometry & MOs

Info

ID:	130691
PubChem CID:	51092062
Reduced:	O2N3C20H27 (1)
Stoich.:	A2B3C20D27 (1)
Weight, g/mol:	346.06551
ΔH_f, kcal/mol:	-47.09
Dipole, Da:	3.44
IP(EA), eV:	-8.85(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-(4-chlorophenyl)-5-methyl-1,3-thiazol-2-yl]methyl]-2-pyrazol-1-ylacetamide

Drug info:

PubChemData

Smile

CC(C)(C)N1C=C(C=N1)C(=O)N2CCC(CC2)COC3=CC=CC=C3

DOS

IR

Vibrations