Geometry & MOs

Info

ID:	372800
PubChem CID:	131305014
Reduced:	N3H4C5 (2)
Stoich.:	A3B4C5 (2)
Weight, g/mol:	238.980777
ΔH_f, kcal/mol:	116.63
Dipole, Da:	3.33
IP(EA), eV:	-9.42(-1.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-chloro-3-hydroxyphenyl)-1,3-thiazole-4-carbaldehyde

Drug info:

PubChemData

Smile

CC1=NC=C(C=N1)NC2=NC=C(C=N2)C#N

DOS

IR

Vibrations