Geometry & MOs

Info

ID:	230787
PubChem CID:	87571998
Reduced:	NOC5H7 (2)
Stoich.:	ABC5D7 (2)
Weight, g/mol:	205.146664
ΔH_f, kcal/mol:	-32.7
Dipole, Da:	4.32
IP(EA), eV:	-9.45(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-[(E)-hex-2-enoxy]phenyl]methanamine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C[C@@H](CN(C=O)O)N

DOS

IR

Vibrations