Geometry & MOs

Info

ID:	322001
PubChem CID:	126667959
Reduced:	OF3N5C23H24 (1)
Stoich.:	AB3C5D23E24 (1)
Weight, g/mol:	509.140768
ΔH_f, kcal/mol:	-103.19
Dipole, Da:	9.02
IP(EA), eV:	-8.86(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)carbamoylamino]-N-methyl-4-(pentafluoro-lambda6-sulfanyl)anilino]ethyl acetate

Drug info:

PubChemData

Smile

C/C=C\N=C(C1=CC=CC=C1C(=O)N[C@@H]2CCC[C@@H]2NC3=NC=C(C=C3)C(F)(F)F)N=C

DOS

IR

Vibrations