Geometry & MOs

Info

ID:	274133
PubChem CID:	103807247
Reduced:	BrFON2C13H18 (1)
Stoich.:	ABCD2E13F18 (1)
Weight, g/mol:	272.163711
ΔH_f, kcal/mol:	-83.08
Dipole, Da:	4.37
IP(EA), eV:	-9.54(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(aminomethyl)cyclohexyl]pyrazolo[1,5-a]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)C(C)(CN)NC(=O)C1=CC(=C(C=C1)F)Br

DOS

IR

Vibrations