Geometry & MOs

Info

ID:	228371
PubChem CID:	87564115
Reduced:	N2F3O4C16H19 (1)
Stoich.:	A2B3C4D16E19 (1)
Weight, g/mol:	197.97926
ΔH_f, kcal/mol:	-276.02
Dipole, Da:	4.24
IP(EA), eV:	-9.24(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-1,4-dihydropyrrolo[3,2-c]pyridine

Drug info:

PubChemData

Smile

CCOC(=O)N(C(C)C1=CC2=C(CNCC2)C=C1)OC(=O)C(F)(F)F

DOS

IR

Vibrations