Geometry & MOs

Info

ID:	135952
PubChem CID:	51958220
Reduced:	OF2N3C18H21 (1)
Stoich.:	AB2C3D18E21 (1)
Weight, g/mol:	412.091535
ΔH_f, kcal/mol:	-86.91
Dipole, Da:	2.61
IP(EA), eV:	-9.26(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-3-(thiophen-2-ylsulfonylamino)benzamide

Drug info:

PubChemData

Smile

C[C@@H](C(C)C)NC(=O)C1=NN(C2=C1CCC2)C3=CC(=C(C=C3)F)F

DOS

IR

Vibrations