Geometry & MOs

Info

ID:	82484
PubChem CID:	49856088
Reduced:	FN2O2C24H29 (1)
Stoich.:	AB2C2D24E29 (1)
Weight, g/mol:	459.121051
ΔH_f, kcal/mol:	-85.29
Dipole, Da:	4.85
IP(EA), eV:	-8.65(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C[C@@H]1CCCN1CCCOC2=CC=C(C=C2)C(=O)CN3CC4=C(C3)C=C(C=C4)F

DOS

IR

Vibrations