Geometry & MOs

Info

ID:	272876
PubChem CID:	103763253
Reduced:	BrClNOC15H17 (1)
Stoich.:	ABCDE15F17 (1)
Weight, g/mol:	366.96108
ΔH_f, kcal/mol:	-38.27
Dipole, Da:	3.0
IP(EA), eV:	-9.27(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[(2-bromo-4-chlorobenzoyl)amino]benzoate

Drug info:

PubChemData

Smile

C1CCC(=CC1)CCNC(=O)C2=C(C=C(C=C2)Cl)Br

DOS

IR

Vibrations