Geometry & MOs

Info

ID:	247030
PubChem CID:	103066640
Reduced:	NOC12H17 (1)
Stoich.:	ABC12D17 (1)
Weight, g/mol:	237.152892
ΔH_f, kcal/mol:	-11.96
Dipole, Da:	2.9
IP(EA), eV:	-8.61(0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-tert-butyl-2-[(4-fluorophenoxy)methyl]prop-2-en-1-amine

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)OCC(=C)CNC

DOS

IR

Vibrations