Geometry & MOs

Info

ID:	405931
PubChem CID:	135076029
Reduced:	ION3C14H16 (1)
Stoich.:	ABC3D14E16 (1)
Weight, g/mol:	300.088576
ΔH_f, kcal/mol:	66.9
Dipole, Da:	4.3
IP(EA), eV:	-9.51(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-cyano-2,3,5,6-tetrafluorophenyl)-1-propylcyclopropane-1-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CN2C(=C(N=N2)COCC=C)I

DOS

IR

Vibrations