Geometry & MOs

Info

ID:	274707
PubChem CID:	103811187
Reduced:	ClON2F3H8C11 (1)
Stoich.:	ABC2D3E8F11 (1)
Weight, g/mol:	234.055991
ΔH_f, kcal/mol:	-168.71
Dipole, Da:	6.06
IP(EA), eV:	-9.57(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-chloro-4-cyanophenyl)-2-cyclopropylacetamide

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1C#N)Cl)NC(=O)CCC(F)(F)F

DOS

IR

Vibrations