Geometry & MOs

Info

ID:	245497
PubChem CID:	99445270
Reduced:	N2O2C12H15 (2)
Stoich.:	A2B2C12D15 (2)
Weight, g/mol:	386.127584
ΔH_f, kcal/mol:	-89.62
Dipole, Da:	4.09
IP(EA), eV:	-8.74(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-N-[(2S)-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)C1=CC(=NC2=C1C=NN2C(C)C)C3=CC4=C(C=C3)OCCO4

DOS

IR

Vibrations