Geometry & MOs

Info

ID:	440469
PubChem CID:	135230447
Reduced:	S2N8H12C13 (1)
Stoich.:	A2B8C12D13 (1)
Weight, g/mol:	355.9972
ΔH_f, kcal/mol:	178.58
Dipole, Da:	7.45
IP(EA), eV:	-9.07(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[6-(bromomethyl)pyridin-2-yl]-2,2-difluoro-2-phenoxyacetamide

Drug info:

PubChemData

Smile

CN1C(=NN=N1)N2C3=CC=CC=C3N=C2SCC4=CSC(=N4)N

DOS

IR

Vibrations