Geometry & MOs

Info

ID:	205340
PubChem CID:	80089279
Reduced:	SN2C14H26 (1)
Stoich.:	AB2C14D26 (1)
Weight, g/mol:	257.134656
ΔH_f, kcal/mol:	-19.84
Dipole, Da:	5.48
IP(EA), eV:	-8.04(0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-chloro-4-fluorophenyl)-N,2-diethylbutan-1-amine

Drug info:

PubChemData

Smile

CCCNC(CC1=NC(=CS1)C)C(CC)CC

DOS

IR

Vibrations