Geometry & MOs

Info

ID:	78854
PubChem CID:	49738001
Reduced:	OS2N4C18H18 (1)
Stoich.:	AB2C4D18E18 (1)
Weight, g/mol:	350.09681
ΔH_f, kcal/mol:	33.29
Dipole, Da:	4.3
IP(EA), eV:	-8.28(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[(5-chloropyridin-2-yl)amino]-1,3-thiazol-4-yl]-1-(4-methylpiperidin-1-yl)ethanone

Drug info:

PubChemData

Smile

CC1=CC(=NC=C1)NC2=NC(=CS2)CC(=O)NC3=CC(=CC=C3)SC

DOS

IR

Vibrations