Geometry & MOs

Info

ID:	273023
PubChem CID:	103770340
Reduced:	F2O2N5C11H11 (1)
Stoich.:	A2B2C5D11E11 (1)
Weight, g/mol:	291.074071
ΔH_f, kcal/mol:	-81.19
Dipole, Da:	5.55
IP(EA), eV:	-10.43(-1.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,3-difluoro-2-hydroxypropyl)-2-(4-methoxyphenyl)sulfanylacetamide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C(=O)NCC(C(F)F)O)N2C=NN=N2

DOS

IR

Vibrations