Geometry & MOs

Info

ID:	166265
PubChem CID:	74659104
Reduced:	NOC10H12 (2)
Stoich.:	ABC10D12 (2)
Weight, g/mol:	479.187878
ΔH_f, kcal/mol:	-31.56
Dipole, Da:	6.11
IP(EA), eV:	-8.82(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-(furan-2-ylmethylsulfamoyl)phenyl]-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]prop-2-enamide

Drug info:

PubChemData

Smile

CC1=CC=C(O1)C=CC(=O)NCC2=CC=CC=C2CN3CCCC3

DOS

IR

Vibrations