Geometry & MOs

Info

ID:	293319
PubChem CID:	117384272
Reduced:	SO3C13H16 (1)
Stoich.:	AB3C13D16 (1)
Weight, g/mol:	252.163791
ΔH_f, kcal/mol:	-105.28
Dipole, Da:	4.84
IP(EA), eV:	-9.14(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-(2-fluoro-4-methoxy-5-methylphenyl)-1-methylpyrrolidin-3-yl]methanamine

Drug info:

PubChemData

Smile

CSC1=C(C=C(C=C1)C(CC(=O)O)C2CC2)O

DOS

IR

Vibrations