Geometry & MOs

Info

ID:	156410
PubChem CID:	56370499
Reduced:	BrON4C21H23 (1)
Stoich.:	ABC4D21E23 (1)
Weight, g/mol:	417.135842
ΔH_f, kcal/mol:	-15.37
Dipole, Da:	8.67
IP(EA), eV:	-8.6(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[5-(cyclopropylsulfamoyl)-2-methoxyphenyl]-3-[(1R,2S)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]urea

Drug info:

PubChemData

Smile

CCN1C2=CC=CC=C2N=C1C3CCCN3C(=O)NC4=C(C=C(C=C4)C)Br

DOS

IR

Vibrations