Geometry & MOs

Info

ID:	350750
PubChem CID:	127279038
Reduced:	BrNO2C11H14 (1)
Stoich.:	ABC2D11E14 (1)
Weight, g/mol:	238.168128
ΔH_f, kcal/mol:	-61.4
Dipole, Da:	4.74
IP(EA), eV:	-9.45(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,2-dimethylpyrrolidine-1-carbonyl)-1-methylpiperidin-2-one

Drug info:

PubChemData

Smile

CC1(CCCN1C(=O)C2=COC(=C2)Br)C

DOS

IR

Vibrations