Geometry & MOs

Info

ID:	156612
PubChem CID:	56371346
Reduced:	FO4N5C26H30 (1)
Stoich.:	AB4C5D26E30 (1)
Weight, g/mol:	458.198777
ΔH_f, kcal/mol:	-189.22
Dipole, Da:	3.61
IP(EA), eV:	-8.13(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(dimethylsulfamoyl)-N-[4-oxo-4-(3-pyrrolidin-1-ylanilino)butan-2-yl]benzamide

Drug info:

PubChemData

Smile

CC(CC(=O)NC1=CC(=CC=C1)N2CCCC2)NC(=O)CN3C(=O)C(NC3=O)(C)C4=CC=C(C=C4)F

DOS

IR

Vibrations