Geometry & MOs

Info

ID:	135397
PubChem CID:	51866681
Reduced:	SN3O4C23H31 (1)
Stoich.:	AB3C4D23E31 (1)
Weight, g/mol:	445.203528
ΔH_f, kcal/mol:	-139.11
Dipole, Da:	6.64
IP(EA), eV:	-8.76(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-methyl-4-[3-[(2S)-2-phenylmorpholin-4-yl]propylsulfamoyl]phenyl]propanamide

Drug info:

PubChemData

Smile

CCC(=O)NC1=CC(=C(C=C1)S(=O)(=O)NCCCN2CCO[C@@H](C2)C3=CC=CC=C3)C

DOS

IR

Vibrations