Geometry & MOs

Info

ID:	277080
PubChem CID:	103826632
Reduced:	BrClN2O3C14H16 (1)
Stoich.:	ABC2D3E14F16 (1)
Weight, g/mol:	363.96142
ΔH_f, kcal/mol:	-103.9
Dipole, Da:	1.81
IP(EA), eV:	-9.52(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-5-chloro-N-[3-(cyanomethoxy)phenyl]benzamide

Drug info:

PubChemData

Smile

COCC(=O)N1CCN(CC1)C(=O)C2=CC(=CC(=C2)Br)Cl

DOS

IR

Vibrations