Geometry & MOs

Info

ID:	203509
PubChem CID:	79839984
Reduced:	ClF2N2H9C12 (1)
Stoich.:	AB2C2D9E12 (1)
Weight, g/mol:	225.012746
ΔH_f, kcal/mol:	-46.49
Dipole, Da:	4.04
IP(EA), eV:	-8.99(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-N-(1,3-thiazol-4-ylmethyl)pyridin-4-amine

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1F)F)CNC2=C(C=NC=C2)Cl

DOS

IR

Vibrations