Geometry & MOs

Info

ID:	206089
PubChem CID:	80200813
Reduced:	ClNSF2H14C15 (1)
Stoich.:	ABCD2E14F15 (1)
Weight, g/mol:	292.03236
ΔH_f, kcal/mol:	-54.91
Dipole, Da:	2.68
IP(EA), eV:	-8.78(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CNC(CSC1=CC=C(C=C1)F)C2=C(C=C(C=C2)Cl)F

DOS

IR

Vibrations