Geometry & MOs

Info

ID:	157044
PubChem CID:	56413051
Reduced:	SO2N4C25H36 (1)
Stoich.:	AB2C4D25E36 (1)
Weight, g/mol:	480.240641
ΔH_f, kcal/mol:	-60.94
Dipole, Da:	2.82
IP(EA), eV:	-8.34(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[[(2S)-1-[4-[(2,6-dimethylmorpholin-4-yl)methyl]piperidin-1-yl]-1-oxopropan-2-yl]sulfamoyl]phenyl]acetamide

Drug info:

PubChemData

Smile

CC1CN(CC(O1)C)CC2CCN(CC2)C(=O)CSC3=NC=CN3C4=CC=CC(=C4C)C

DOS

IR

Vibrations