Geometry & MOs

Info

ID:	83163
PubChem CID:	49857229
Reduced:	ION6H11C16 (1)
Stoich.:	ABC6D11E16 (1)
Weight, g/mol:	470.146931
ΔH_f, kcal/mol:	140.73
Dipole, Da:	9.06
IP(EA), eV:	-9.03(-1.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-(5-chloro-2-methoxyphenyl)-1-[2-(2-methoxyethoxy)ethyl]pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)N2C(=CC=N2)NC(=O)C3=C4N=CC=CN4N=C3)I

DOS

IR

Vibrations