Geometry & MOs

Info

ID:	343082
PubChem CID:	127266255
Reduced:	FSN2O3C15H17 (1)
Stoich.:	ABC2D3E15F17 (1)
Weight, g/mol:	334.99393
ΔH_f, kcal/mol:	-126.6
Dipole, Da:	8.26
IP(EA), eV:	-9.74(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[(4-bromophenyl)sulfonylamino]ethyl]-3-methylurea

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)OC)S(=O)(=O)N[C@H](C)C2=CC(=CN=C2)F

DOS

IR

Vibrations