Geometry & MOs

Info

ID:	303167
PubChem CID:	124489301
Reduced:	ON2C15H22 (1)
Stoich.:	AB2C15D22 (1)
Weight, g/mol:	270.093519
ΔH_f, kcal/mol:	-36.25
Dipole, Da:	6.06
IP(EA), eV:	-9.16(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-chloro-2-fluorophenyl)-[(3S)-3-(methylaminomethyl)pyrrolidin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CC(=O)N2CC[C@@H](C2)CNC

DOS

IR

Vibrations