Geometry & MOs

Info

ID:	306832
PubChem CID:	125258700
Reduced:	FON2C16H21 (1)
Stoich.:	ABC2D16E21 (1)
Weight, g/mol:	276.163791
ΔH_f, kcal/mol:	-88.19
Dipole, Da:	3.16
IP(EA), eV:	-8.86(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3aS,4S,8bS)-8-fluoro-2-propan-2-yl-3,3a,4,8b-tetrahydro-1H-indeno[2,3-c]pyrrol-4-yl]acetamide

Drug info:

PubChemData

Smile

CC(C)N1C[C@H]2[C@@H](C1)C3=C([C@H]2NC(=O)C)C=CC=C3F

DOS

IR

Vibrations