Geometry & MOs

Info

ID:	243842
PubChem CID:	99289338
Reduced:	SN3O4C24H33 (1)
Stoich.:	AB3C4D24E33 (1)
Weight, g/mol:	443.187878
ΔH_f, kcal/mol:	-134.83
Dipole, Da:	5.01
IP(EA), eV:	-8.59(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3R)-1-cyclopropylpyrrolidin-3-yl]-3-[(4-ethylphenyl)sulfamoyl]-4-methoxybenzamide

Drug info:

PubChemData

Smile

C[C@H]1CN(C[C@@H](O1)C)C[C@@H]2CCCN2C(=O)CN(C)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

DOS

IR

Vibrations