Geometry & MOs

Info

ID:	406474
PubChem CID:	135077722
Reduced:	NO3C20H23 (1)
Stoich.:	AB3C20D23 (1)
Weight, g/mol:	378.055832
ΔH_f, kcal/mol:	-91.42
Dipole, Da:	3.65
IP(EA), eV:	-9.4(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1R,2R)-1-[(2,3,4,5,6-pentafluorobenzoyl)amino]-2,3-dihydro-1H-inden-2-yl]azanium;chloride

Drug info:

PubChemData

Smile

CC1(OCCO1)CC(=O)N(CC2=CC=CC=C2)CC3=CC=CC=C3

DOS

IR

Vibrations