Geometry & MOs

Info

ID:	207162
PubChem CID:	80354621
Reduced:	SN3C10H17 (1)
Stoich.:	AB3C10D17 (1)
Weight, g/mol:	258.120213
ΔH_f, kcal/mol:	20.0
Dipole, Da:	4.7
IP(EA), eV:	-8.15(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(dimethylamino)ethylsulfanyl]-4-ethoxy-5-fluoroaniline

Drug info:

PubChemData

Smile

CC1=CC(=NC=C1N)SCCN(C)C

DOS

IR

Vibrations