Geometry & MOs

Info

ID:	69702
PubChem CID:	47205209
Reduced:	ON4C15H16 (1)
Stoich.:	AB4C15D16 (1)
Weight, g/mol:	290.029603
ΔH_f, kcal/mol:	29.34
Dipole, Da:	3.38
IP(EA), eV:	-8.67(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1H-pyrazol-5-ylmethyl)-2-thiophen-2-yl-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC2=CC=CC=C2N1CC(=O)NCC3=CC=NN3

DOS

IR

Vibrations