Geometry & MOs

Info

ID:	273871
PubChem CID:	103805533
Reduced:	N2O2F3C14H19 (1)
Stoich.:	A2B2C3D14E19 (1)
Weight, g/mol:	350.043
ΔH_f, kcal/mol:	-238.38
Dipole, Da:	1.91
IP(EA), eV:	-8.88(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-N-[3-(ethylaminomethyl)phenyl]-4-fluorobenzamide

Drug info:

PubChemData

Smile

CCNCC1=CC(=CC=C1)NC(=O)CCOCC(F)(F)F

DOS

IR

Vibrations