Geometry & MOs

Info

ID:	155158
PubChem CID:	56320856
Reduced:	SN3O5C20H23 (1)
Stoich.:	AB3C5D20E23 (1)
Weight, g/mol:	418.08481
ΔH_f, kcal/mol:	-142.63
Dipole, Da:	6.41
IP(EA), eV:	-9.36(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[6-(3-carbamoylphenoxy)pyridin-3-yl]-2-pyrimidin-2-yl-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

C1CC1NS(=O)(=O)C2=CC=CC(=C2)C(=O)NCCCNC(=O)C3=CC(=CC=C3)O

DOS

IR

Vibrations