Geometry & MOs

Info

ID:	277004
PubChem CID:	103826215
Reduced:	FON4C10H15 (1)
Stoich.:	ABC4D10E15 (1)
Weight, g/mol:	319.00687
ΔH_f, kcal/mol:	-58.53
Dipole, Da:	5.19
IP(EA), eV:	-9.01(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-bromofuran-2-yl)methyl]-3-(2H-tetrazol-5-yl)aniline

Drug info:

PubChemData

Smile

CC(C)(CNC1=NC=C(C=N1)F)C(=O)NC

DOS

IR

Vibrations