Geometry & MOs

Info

ID:	172658
PubChem CID:	75537187
Reduced:	NO2C5H6 (2)
Stoich.:	AB2C5D6 (2)
Weight, g/mol:	356.130697
ΔH_f, kcal/mol:	-139.46
Dipole, Da:	0.49
IP(EA), eV:	-8.72(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-N-[2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]ethyl]pyrazole-3-carboxamide

Drug info:

PubChemData

Smile

COC(=O)C(C1=C(C=CC=N1)N)C(=O)OC

DOS

IR

Vibrations