Geometry & MOs

Info

ID:	305479
PubChem CID:	124956036
Reduced:	ON4C20H26 (1)
Stoich.:	AB4C20D26 (1)
Weight, g/mol:	483.194026
ΔH_f, kcal/mol:	3.63
Dipole, Da:	4.14
IP(EA), eV:	-8.41(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[(3R)-3-hydroxy-1-(1,6-naphthyridin-4-yl)piperidin-3-yl]methyl]-N-methyl-3-(4-sulfamoylphenyl)propanamide

Drug info:

PubChemData

Smile

C1C[C@H](CN(C1)C(=O)CCN2CCC3=CC=CC=C32)CC4=CC=NN4

DOS

IR

Vibrations