Geometry & MOs

Info

ID:	448759
PubChem CID:	135293407
Reduced:	ON5F7H18C22 (1)
Stoich.:	AB5C7D18E22 (1)
Weight, g/mol:	211.157229
ΔH_f, kcal/mol:	-251.05
Dipole, Da:	4.78
IP(EA), eV:	-8.72(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-ethenoxybutyl)-3-methyl-2-methylidenebutanamide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C(F)(F)F)OC2=CN=C(C=C2)C(C(CN(/C=N\N)N)C3=C(C=C(C=C3)F)F)(F)F

DOS

IR

Vibrations