Geometry & MOs

Info

ID:	126590
PubChem CID:	50969030
Reduced:	O3N4C19H22 (1)
Stoich.:	A3B4C19D22 (1)
Weight, g/mol:	236.106196
ΔH_f, kcal/mol:	-73.76
Dipole, Da:	6.43
IP(EA), eV:	-8.9(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-(1H-pyrazol-5-yl)phenyl]pyridin-2-amine

Drug info:

PubChemData

Smile

CC1=NC2=C(CCN(CC2)CCN3C4=CC=CC=C4OC3=O)C(=O)N1C

DOS

IR

Vibrations