Geometry & MOs

Info

ID:	212084
PubChem CID:	81059411
Reduced:	OCl2N2C14H22 (1)
Stoich.:	AB2C2D14E22 (1)
Weight, g/mol:	288.140469
ΔH_f, kcal/mol:	-49.84
Dipole, Da:	3.71
IP(EA), eV:	-9.24(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-chloro-3-fluorophenyl)-N-methyl-N-(2-propan-2-yloxyethyl)ethane-1,2-diamine

Drug info:

PubChemData

Smile

CC(C)OCCN(C)C(CN)C1=CC(=C(C=C1)Cl)Cl

DOS

IR

Vibrations