Geometry & MOs

Info

ID:	72631
PubChem CID:	48416379
Reduced:	N4O5C21H30 (1)
Stoich.:	A4B5C21D30 (1)
Weight, g/mol:	408.0797
ΔH_f, kcal/mol:	-195.11
Dipole, Da:	3.77
IP(EA), eV:	-8.45(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-N-[2-oxo-2-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]ethyl]benzamide

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1)C(=O)NCC(=O)N2CCCC(C2)N3CCNC3=O)OCC

DOS

IR

Vibrations