Geometry & MOs

Info

ID:	247069
PubChem CID:	103067192
Reduced:	FN2O3C14H19 (1)
Stoich.:	AB2C3D14E19 (1)
Weight, g/mol:	225.092042
ΔH_f, kcal/mol:	-68.41
Dipole, Da:	7.13
IP(EA), eV:	-9.2(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-chloro-4-methylphenoxy)methyl]-N-methylprop-2-en-1-amine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations