Geometry & MOs

Info

ID:	268050
PubChem CID:	103597581
Reduced:	SN2H14C19 (1)
Stoich.:	AB2C14D19 (1)
Weight, g/mol:	378.103814
ΔH_f, kcal/mol:	103.12
Dipole, Da:	2.37
IP(EA), eV:	-9.05(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dimethoxy-3-[2-(2-methylquinolin-4-yl)-1,3-thiazol-4-yl]phenol

Drug info:

PubChemData

Smile

CC1=NC2=CC=CC=C2C(=C1)C3=NC(=CS3)C4=CC=CC=C4

DOS

IR

Vibrations