Geometry & MOs

Info

ID:	142628
PubChem CID:	53069090
Reduced:	SN3O5C19H25 (1)
Stoich.:	AB3C5D19E25 (1)
Weight, g/mol:	304.109293
ΔH_f, kcal/mol:	-163.26
Dipole, Da:	4.59
IP(EA), eV:	-8.56(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-(3-methoxypropylsulfamoyl)-1,5-dimethylpyrrole-2-carboxylate

Drug info:

PubChemData

Smile

CC1=C(C=C(N1C)C(=O)OC)S(=O)(=O)N2CCN(CC2)C3=CC=C(C=C3)OC

DOS

IR

Vibrations