Geometry & MOs

Info

ID:	264547
PubChem CID:	103469387
Reduced:	N6H10C15 (1)
Stoich.:	A6B10C15 (1)
Weight, g/mol:	253.05753
ΔH_f, kcal/mol:	154.74
Dipole, Da:	6.62
IP(EA), eV:	-9.01(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-6-[4-(trifluoromethyl)pyrazol-1-yl]pyridine-3-carbonitrile

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)N=C(N2C3=NC(=C(C=C3)N)C#N)CC#N

DOS

IR

Vibrations