Geometry & MOs

Info

ID:	60781
PubChem CID:	26702143
Reduced:	N2O4C23H24 (1)
Stoich.:	A2B4C23D24 (1)
Weight, g/mol:	337.01137
ΔH_f, kcal/mol:	-127.87
Dipole, Da:	4.93
IP(EA), eV:	-8.63(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-N-(2-fluoro-4-methylphenyl)-4-methoxybenzamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)[C@H]2CCCN2C(=O)C3=CC=C(C=C3)CN4C(=O)CCC4=O

DOS

IR

Vibrations