Geometry & MOs

Info

ID:	287468
PubChem CID:	104242925
Reduced:	F2N3C16H17 (1)
Stoich.:	A2B3C16D17 (1)
Weight, g/mol:	332.06366
ΔH_f, kcal/mol:	-50.02
Dipole, Da:	5.42
IP(EA), eV:	-9.29(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-bromopyridin-3-yl)-6-cyclopentyl-N-methylpyrimidin-4-amine

Drug info:

PubChemData

Smile

CNC1=NC(=NC(=C1)C2CCCC2)C3=CC(=CC(=C3)F)F

DOS

IR

Vibrations