Geometry & MOs

Info

ID:	245491
PubChem CID:	99445264
Reduced:	NF4O4C17H21 (1)
Stoich.:	AB4C4D17E21 (1)
Weight, g/mol:	355.127586
ΔH_f, kcal/mol:	-354.41
Dipole, Da:	3.82
IP(EA), eV:	-9.28(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(1,3-dithiolan-2-yl)phenoxy]-N-ethyl-N-[(2S)-1-methoxypropan-2-yl]acetamide

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