Geometry & MOs

Info

ID:	273079
PubChem CID:	103770453
Reduced:	NF2O2C12H15 (1)
Stoich.:	AB2C2D12E15 (1)
Weight, g/mol:	261.063506
ΔH_f, kcal/mol:	-187.08
Dipole, Da:	4.85
IP(EA), eV:	-9.58(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CC(=O)NCC(C(F)F)O

DOS

IR

Vibrations