Geometry & MOs

Info

ID:	344175
PubChem CID:	127267351
Reduced:	ON5C18H19 (1)
Stoich.:	AB5C18D19 (1)
Weight, g/mol:	323.17461
ΔH_f, kcal/mol:	49.13
Dipole, Da:	6.42
IP(EA), eV:	-9.37(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-methylpentan-2-yl)-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide

Drug info:

PubChemData

Smile

C1CCC(CC1)NC(=O)C2=C3N=CC=C(N3N=C2)C4=CN=CC=C4

DOS

IR

Vibrations