Geometry & MOs

Info

ID:	250060
PubChem CID:	103093877
Reduced:	ClOF2N3H8C12 (1)
Stoich.:	ABC2D3E8F12 (1)
Weight, g/mol:	279.088688
ΔH_f, kcal/mol:	-76.93
Dipole, Da:	3.07
IP(EA), eV:	-9.12(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N-(3-chloropyridin-2-yl)-5-propan-2-yl-1H-pyrazole-3-carboxamide

Drug info:

PubChemData

Smile

C1=CC(=C(N=C1)NC(=O)C2=C(C=CC(=C2F)N)F)Cl

DOS

IR

Vibrations