Geometry & MOs

Info

ID:	63859
PubChem CID:	26759339
Reduced:	N2F3O6H19C21 (1)
Stoich.:	A2B3C6D19E21 (1)
Weight, g/mol:	410.130028
ΔH_f, kcal/mol:	-371.4
Dipole, Da:	4.13
IP(EA), eV:	-8.51(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)naphthalene-2-carboxamide

Drug info:

PubChemData

Smile

C[C@H](C(=O)NC(=O)NC1=CC2=C(C=C1)OCCO2)OC(=O)CC3=CC(=CC=C3)C(F)(F)F

DOS

IR

Vibrations