Geometry & MOs

Info

ID:	129939
PubChem CID:	51074323
Reduced:	ON5C20H23 (1)
Stoich.:	AB5C20D23 (1)
Weight, g/mol:	347.130363
ΔH_f, kcal/mol:	47.41
Dipole, Da:	6.4
IP(EA), eV:	-9.64(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-4-(methylsulfamoyl)-N-(1-phenylcyclobutyl)pyrrole-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=NC2=NC=NN12)C)CCC(=O)NC3(CCC3)C4=CC=CC=C4

DOS

IR

Vibrations