Geometry & MOs

Info

ID:	273065
PubChem CID:	103770427
Reduced:	NF2O3C13H17 (1)
Stoich.:	AB2C3D13E17 (1)
Weight, g/mol:	289.094806
ΔH_f, kcal/mol:	-226.07
Dipole, Da:	3.14
IP(EA), eV:	-8.9(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,3-difluoro-2-hydroxypropyl)-4-phenylsulfanylbutanamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)OCCC(=O)NCC(C(F)F)O

DOS

IR

Vibrations