Geometry & MOs

Info

ID:	152992
PubChem CID:	56312098
Reduced:	FN3O3C24H30 (1)
Stoich.:	AB3C3D24E30 (1)
Weight, g/mol:	418.156243
ΔH_f, kcal/mol:	-146.44
Dipole, Da:	6.6
IP(EA), eV:	-8.52(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-[[1-(2-methoxyphenyl)pyrrolidin-3-yl]methylsulfamoyl]benzoate

Drug info:

PubChemData

Smile

CC1CN(CCN1C(C)C(=O)NC(C)C2=CC=C(C=C2)F)C3=CC=C(C=C3)C(=O)OC

DOS

IR

Vibrations