Geometry & MOs

Info

ID:	431108
PubChem CID:	135171178
Reduced:	BrClO3C7H10 (1)
Stoich.:	ABC3D7E10 (1)
Weight, g/mol:	230.103083
ΔH_f, kcal/mol:	-152.78
Dipole, Da:	3.51
IP(EA), eV:	-11.05(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-ethyl-2-prop-1-en-2-yl-5-(trifluoromethyl)pyridin-3-amine

Drug info:

PubChemData

Smile

CCOC(=O)CCC(C(=O)Cl)Br

DOS

IR

Vibrations