Geometry & MOs

Info

ID:	372895
PubChem CID:	131306651
Reduced:	IN2O2H9C10 (1)
Stoich.:	AB2C2D9E10 (1)
Weight, g/mol:	252.012412
ΔH_f, kcal/mol:	-24.75
Dipole, Da:	3.73
IP(EA), eV:	-9.17(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-chloro-6-methylpyridin-3-yl)-4-methyl-1,3-thiazole-5-carbaldehyde

Drug info:

PubChemData

Smile

COC(=O)CC1=C(C=CC2=C1N=CN2)I

DOS

IR

Vibrations