Geometry & MOs

Info

ID:	249708
PubChem CID:	103091493
Reduced:	NO2C11H15 (1)
Stoich.:	AB2C11D15 (1)
Weight, g/mol:	191.131014
ΔH_f, kcal/mol:	-50.39
Dipole, Da:	1.18
IP(EA), eV:	-8.38(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-4-[3-(methoxymethyl)phenyl]but-3-en-2-amine

Drug info:

PubChemData

Smile

CC(/C=C/C1=CC(=C(C=C1)OC)O)N

DOS

IR

Vibrations