Geometry & MOs

Info

ID:	247028
PubChem CID:	103066614
Reduced:	NOC14H21 (1)
Stoich.:	ABC14D21 (1)
Weight, g/mol:	191.131014
ΔH_f, kcal/mol:	-23.92
Dipole, Da:	2.33
IP(EA), eV:	-8.56(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3,5-dimethylphenoxy)methyl]prop-2-en-1-amine

Drug info:

PubChemData

Smile

CCNCC(=C)COC1=C(C=CC(=C1)C)C

DOS

IR

Vibrations