Geometry & MOs

Info

ID:	245494
PubChem CID:	99445267
Reduced:	ClSN2O3C18H23 (1)
Stoich.:	ABC2D3E18F23 (1)
Weight, g/mol:	382.111791
ΔH_f, kcal/mol:	-89.81
Dipole, Da:	6.45
IP(EA), eV:	-9.02(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[(4-chlorophenoxy)methyl]-1,3-thiazol-4-yl]-N-ethyl-N-[(2R)-1-methoxypropan-2-yl]acetamide

Drug info:

PubChemData

Smile

CCN([C@@H](C)COC)C(=O)CC1=CSC(=N1)COC2=CC=C(C=C2)Cl

DOS

IR

Vibrations