Geometry & MOs

Info

ID:	243449
PubChem CID:	99222912
Reduced:	SN3O5C23H29 (1)
Stoich.:	AB3C5D23E29 (1)
Weight, g/mol:	445.167142
ΔH_f, kcal/mol:	-167.99
Dipole, Da:	6.51
IP(EA), eV:	-8.76(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-cyclopentyl-2-[[(E)-3-[4-(furan-2-ylmethylsulfamoyl)phenyl]prop-2-enoyl]amino]propanamide

Drug info:

PubChemData

Smile

C[C@H](C(=O)NC1CCCC1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N(C)C3=CC=CC=C3OC

DOS

IR

Vibrations