Geometry & MOs

Info

ID:	83161
PubChem CID:	49857225
Reduced:	NOC11H17 (2)
Stoich.:	ABC11D17 (2)
Weight, g/mol:	304.107259
ΔH_f, kcal/mol:	-85.2
Dipole, Da:	1.28
IP(EA), eV:	-8.83(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-phenylpyrazol-3-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

Drug info:

PubChemData

Smile

C[C@H]1CCCN1CCCOC2=CC=C(C=C2)C(=O)C(C)N3CCCCC3

DOS

IR

Vibrations