Geometry & MOs

Info

ID:	247063
PubChem CID:	103067127
Reduced:	FN2O3C14H19 (1)
Stoich.:	AB2C3D14E19 (1)
Weight, g/mol:	304.038148
ΔH_f, kcal/mol:	-74.92
Dipole, Da:	6.95
IP(EA), eV:	-9.23(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2,6-dichloro-4-nitrophenoxy)methyl]-N-ethylprop-2-en-1-amine

Drug info:

PubChemData

Smile

CC(C)(C)NCC(=C)COC1=CC(=C(C=C1)[N+](=O)[O-])F

DOS

IR

Vibrations