Geometry & MOs

Info

ID:	245498
PubChem CID:	99445271
Reduced:	SN2O2F3C18H21 (1)
Stoich.:	AB2C2D3E18F21 (1)
Weight, g/mol:	386.127584
ΔH_f, kcal/mol:	-204.48
Dipole, Da:	7.28
IP(EA), eV:	-9.22(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations