Geometry & MOs

Info

ID:	271894
PubChem CID:	103696931
Reduced:	SN4C8H14 (1)
Stoich.:	AB4C8D14 (1)
Weight, g/mol:	217.06697
ΔH_f, kcal/mol:	39.02
Dipole, Da:	2.82
IP(EA), eV:	-8.92(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-5-fluoro-N-(3-methoxypropyl)aniline

Drug info:

PubChemData

Smile

CCC1=CN=C(S1)CNC(=NC)N

DOS

IR

Vibrations