Geometry & MOs

Info

ID:	408360
PubChem CID:	135081126
Reduced:	NO6C9H17 (1)
Stoich.:	AB6C9D17 (1)
Weight, g/mol:	177.095378
ΔH_f, kcal/mol:	-283.14
Dipole, Da:	3.44
IP(EA), eV:	-9.94(0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-5-(4-fluorophenyl)-2-methyl-3,4-dihydro-2H-pyrrole

Drug info:

PubChemData

Smile

CC(=O)NC1[C@@H](OC([C@H](C1O)O)COC)O

DOS

IR

Vibrations