Geometry & MOs

Info

ID:	265576
PubChem CID:	103531269
Reduced:	NO5C12H21 (1)
Stoich.:	AB5C12D21 (1)
Weight, g/mol:	297.03644
ΔH_f, kcal/mol:	-225.81
Dipole, Da:	3.05
IP(EA), eV:	-9.54(0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(bromomethyl)phenyl]-(3-methoxypyrrolidin-1-yl)methanone

Drug info:

PubChemData

Smile

CCOC(=O)CCC(=O)N1CC(C(C1)OC)OC

DOS

IR

Vibrations