Geometry & MOs

Info

ID:	78822
PubChem CID:	49737748
Reduced:	OSN4C20H22 (1)
Stoich.:	ABC4D20E22 (1)
Weight, g/mol:	411.136511
ΔH_f, kcal/mol:	10.2
Dipole, Da:	4.74
IP(EA), eV:	-8.61(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-acetamido-2-methoxyphenyl)-2-[2-[(6-methylpyridin-2-yl)amino]-1,3-thiazol-4-yl]acetamide

Drug info:

PubChemData

Smile

CC1=NC(=CC=C1)NC2=NC(=CS2)CC(=O)NC3=C(C=C(C=C3C)C)C

DOS

IR

Vibrations