Geometry & MOs

Info

ID:	292644
PubChem CID:	117356293
Reduced:	ClNO2C12H16 (1)
Stoich.:	ABC2D12E16 (1)
Weight, g/mol:	241.086957
ΔH_f, kcal/mol:	-51.49
Dipole, Da:	2.47
IP(EA), eV:	-8.5(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4-chloro-2,3-dimethoxyphenyl)methyl]cyclopropan-1-amine

Drug info:

PubChemData

Smile

COC1=C(C=C(C(=C1)CC2(CC2)N)Cl)OC

DOS

IR

Vibrations