Geometry & MOs

Info

ID:	292648
PubChem CID:	117356306
Reduced:	ClNO2C12H16 (1)
Stoich.:	ABC2D12E16 (1)
Weight, g/mol:	241.086957
ΔH_f, kcal/mol:	-71.81
Dipole, Da:	1.99
IP(EA), eV:	-8.9(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-chloro-3-(2-methylprop-2-enoxy)phenyl]-N-methoxymethanamine

Drug info:

PubChemData

Smile

C1CCC2=CC(=C(C(=C2CC1)CNO)O)Cl

DOS

IR

Vibrations