Geometry & MOs

Info

ID:	273057
PubChem CID:	103770406
Reduced:	NF2O2C12H17 (1)
Stoich.:	AB2C2D12E17 (1)
Weight, g/mol:	289.094806
ΔH_f, kcal/mol:	-172.26
Dipole, Da:	5.48
IP(EA), eV:	-10.1(0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,3-difluoro-2-hydroxypropyl)-2-(2,5-dimethylphenyl)sulfanylacetamide

Drug info:

PubChemData

Smile

C1CC2CC1C3C2C3C(=O)NCC(C(F)F)O

DOS

IR

Vibrations