Geometry & MOs

Info

ID:	406185
PubChem CID:	135076847
Reduced:	BrNOF3C12H13 (1)
Stoich.:	ABCD3E12F13 (1)
Weight, g/mol:	177.115364
ΔH_f, kcal/mol:	-191.36
Dipole, Da:	5.72
IP(EA), eV:	-9.95(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-5-(3-methylbut-1-en-2-yloxy)pyridine

Drug info:

PubChemData

Smile

CC(C)(C)N(C1=CC=CC=C1Br)C(=O)C(F)(F)F

DOS

IR

Vibrations