Geometry & MOs

Info

ID:	294369
PubChem CID:	117454597
Reduced:	ClO3C15H19 (1)
Stoich.:	AB3C15D19 (1)
Weight, g/mol:	282.113506
ΔH_f, kcal/mol:	-105.22
Dipole, Da:	3.86
IP(EA), eV:	-9.06(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[5-chloro-3-methoxy-2-(1-methylazetidin-3-yl)oxyphenyl]cyclopropan-1-amine

Drug info:

PubChemData

Smile

CC(C)C1=C2C(=C(C=C1C3(CC3)O)Cl)OCCCO2

DOS

IR

Vibrations