Geometry & MOs

Info

ID:	205969
PubChem CID:	80185222
Reduced:	NO4C12H23 (1)
Stoich.:	AB4C12D23 (1)
Weight, g/mol:	266.123069
ΔH_f, kcal/mol:	-201.41
Dipole, Da:	3.9
IP(EA), eV:	-9.43(0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-cyanopropyl)-2-(2,4-difluorophenyl)-N-ethylacetamide

Drug info:

PubChemData

Smile

CC(CC(=O)N(C)CCCC(=O)OC)COC

DOS

IR

Vibrations