Geometry & MOs

Info

ID:	303077
PubChem CID:	124489182
Reduced:	ClNOC12H14 (1)
Stoich.:	ABCD12E14 (1)
Weight, g/mol:	223.076392
ΔH_f, kcal/mol:	-34.79
Dipole, Da:	3.0
IP(EA), eV:	-9.44(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3R)-3-(chloromethyl)pyrrolidin-1-yl]-phenylmethanone

Drug info:

PubChemData

Smile

C1CN(C[C@H]1CCl)C(=O)C2=CC=CC=C2

DOS

IR

Vibrations