Geometry & MOs

Info

ID:	266076
PubChem CID:	103558326
Reduced:	ClNO3C12H20 (1)
Stoich.:	ABC3D12E20 (1)
Weight, g/mol:	303.08339
ΔH_f, kcal/mol:	-143.23
Dipole, Da:	3.64
IP(EA), eV:	-9.55(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(bromomethyl)-3-methylpyrrolidin-1-yl]-2-(1-methoxycyclobutyl)ethanone

Drug info:

PubChemData

Smile

COC1(CCC1)CC(=O)N2CCOCC2CCl

DOS

IR

Vibrations