Geometry & MOs

Info

ID:	245490
PubChem CID:	99445263
Reduced:	NF4O4C17H21 (1)
Stoich.:	AB4C4D17E21 (1)
Weight, g/mol:	379.140671
ΔH_f, kcal/mol:	-352.22
Dipole, Da:	3.84
IP(EA), eV:	-9.07(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-[2,4-bis(difluoromethoxy)phenyl]-N-ethyl-N-[(2R)-1-methoxypropan-2-yl]prop-2-enamide

Drug info:

PubChemData

Smile

CCN([C@@H](C)COC)C(=O)/C=C/C1=C(C=C(C=C1)OC(F)F)OC(F)F

DOS

IR

Vibrations