Geometry & MOs

Info

ID:	205361
PubChem CID:	80092139
Reduced:	N3O4H11C12 (1)
Stoich.:	A3B4C11D12 (1)
Weight, g/mol:	341.95708
ΔH_f, kcal/mol:	-140.56
Dipole, Da:	5.99
IP(EA), eV:	-10.26(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-N-(3-bromo-4-chlorophenyl)-2-fluorobenzamide

Drug info:

PubChemData

Smile

CC1=NC(=C(C=C1)N2C=C(C(=O)NC2=O)C(=O)O)C

DOS

IR

Vibrations