Geometry & MOs

Info

ID:	267408
PubChem CID:	103582129
Reduced:	SO2N3C15H25 (1)
Stoich.:	AB2C3D15E25 (1)
Weight, g/mol:	351.96142
ΔH_f, kcal/mol:	-77.97
Dipole, Da:	4.22
IP(EA), eV:	-8.68(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(4-bromo-3-chlorophenyl)methylamino]-3H-1,3-benzoxazol-2-one

Drug info:

PubChemData

Smile

CC(C)CN1CCC(CC1)NC2=CC(=CC=C2)S(=O)(=O)N

DOS

IR

Vibrations