Geometry & MOs

Info

ID:	290444
PubChem CID:	104528038
Reduced:	SO2N3C15H25 (1)
Stoich.:	AB2C3D15E25 (1)
Weight, g/mol:	383.92959
ΔH_f, kcal/mol:	-87.57
Dipole, Da:	7.52
IP(EA), eV:	-8.8(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-amino-4-(2,4-dibromoanilino)phenyl]ethanone

Drug info:

PubChemData

Smile

CC(C)CCN(C1CCCC1)C2=NC(=CS2)C(C(=O)O)N

DOS

IR

Vibrations