Geometry & MOs

Info

ID:	30329
PubChem CID:	841145
Reduced:	BrNO5C11H12 (1)
Stoich.:	ABC5D11E12 (1)
Weight, g/mol:	297.012347
ΔH_f, kcal/mol:	-135.92
Dipole, Da:	6.9
IP(EA), eV:	-9.25(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dichloro-N-[(4-fluorophenyl)methyl]benzamide

Drug info:

PubChemData

Smile

CCOC1=C(C(=CC(=C1)C=NO)Br)OCC(=O)O

DOS

IR

Vibrations