Geometry & MOs

Info

ID:	303180
PubChem CID:	124489325
Reduced:	ON2C14H20 (1)
Stoich.:	AB2C14D20 (1)
Weight, g/mol:	232.157563
ΔH_f, kcal/mol:	-30.6
Dipole, Da:	5.98
IP(EA), eV:	-9.16(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3S)-3-(methylaminomethyl)pyrrolidin-1-yl]-(4-methylphenyl)methanone

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(=O)N2CC[C@@H](C2)CNC

DOS

IR

Vibrations