Geometry & MOs

Info

ID:	140420
PubChem CID:	52694884
Reduced:	SN3O3C20H25 (1)
Stoich.:	AB3C3D20E25 (1)
Weight, g/mol:	442.156243
ΔH_f, kcal/mol:	-93.25
Dipole, Da:	3.73
IP(EA), eV:	-8.61(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-3-(2,3,4-trimethoxyphenyl)propanamide

Drug info:

PubChemData

Smile

CCCC(=O)N1CCC[C@H]1C(=O)NC2=NC(=C(S2)C)C3=CC=C(C=C3)OC

DOS

IR

Vibrations