Geometry & MOs

Info

ID:	273825
PubChem CID:	103805247
Reduced:	FSN2O2C13H17 (1)
Stoich.:	ABC2D2E13F17 (1)
Weight, g/mol:	341.95708
ΔH_f, kcal/mol:	-123.13
Dipole, Da:	5.08
IP(EA), eV:	-8.44(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-amino-4-fluorophenyl)-2-bromo-4-chlorobenzamide

Drug info:

PubChemData

Smile

C1CC(OC1)CSCC(=O)NC2=CC(=C(C=C2)F)N

DOS

IR

Vibrations