Geometry & MOs

Info

ID:	37237
PubChem CID:	8018616
Reduced:	N2O3C19H24 (1)
Stoich.:	A2B3C19D24 (1)
Weight, g/mol:	416.140593
ΔH_f, kcal/mol:	-109.52
Dipole, Da:	2.42
IP(EA), eV:	-9.8(-1.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]propanamide

Drug info:

PubChemData

Smile

C[C@@H]1CCC[C@@H]([C@H]1C)NC(=O)[C@@H](C)OC(=O)C2=CC=C(C=C2)C#N

DOS

IR

Vibrations