Geometry & MOs

Info

ID:	250055
PubChem CID:	103093833
Reduced:	ClO2N3C14H14 (1)
Stoich.:	AB2C3D14E14 (1)
Weight, g/mol:	279.088688
ΔH_f, kcal/mol:	-31.06
Dipole, Da:	3.19
IP(EA), eV:	-8.25(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N-(3-chloropyridin-2-yl)-2-ethyl-5-methylpyrazole-3-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)N)OCCC(=O)NC2=C(C=CC=N2)Cl

DOS

IR

Vibrations