Geometry & MOs

Info

ID:	290543
PubChem CID:	104643543
Reduced:	ClNO2F3C12H15 (1)
Stoich.:	ABC2D3E12F15 (1)
Weight, g/mol:	300.160456
ΔH_f, kcal/mol:	-236.17
Dipole, Da:	2.35
IP(EA), eV:	-8.58(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-2-[[2-(dimethylamino)ethyl-propylamino]methyl]-6-methoxyphenol

Drug info:

PubChemData

Smile

CN(CCC(F)(F)F)CC1=C(C(=CC(=C1)Cl)OC)O

DOS

IR

Vibrations