Geometry & MOs

Info

ID:	283335
PubChem CID:	103975807
Reduced:	ON4C10H16 (1)
Stoich.:	AB4C10D16 (1)
Weight, g/mol:	266.118591
ΔH_f, kcal/mol:	-9.8
Dipole, Da:	1.51
IP(EA), eV:	-9.37(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(1-aminoethyl)pyrrolidin-1-yl]-(2-chloro-3-methylphenyl)methanone

Drug info:

PubChemData

Smile

CC(C1CCN(C1)C(=O)C2=CNN=C2)N

DOS

IR

Vibrations