Geometry & MOs

Info

ID:	155331
PubChem CID:	56352920
Reduced:	FO2N4C28H33 (1)
Stoich.:	AB2C4D28E33 (1)
Weight, g/mol:	485.234828
ΔH_f, kcal/mol:	-55.61
Dipole, Da:	3.98
IP(EA), eV:	-8.8(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3-dimethylphenyl)-4-[4-(2-morpholin-4-ylethyl)piperidine-1-carbonyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=NN(C=C2C(=O)N3CCC(CC3)CCN4CCOCC4)C5=CC=C(C=C5)F

DOS

IR

Vibrations