Geometry & MOs

Info

ID:	72975
PubChem CID:	48416752
Reduced:	O2N3C20H29 (1)
Stoich.:	A2B3C20D29 (1)
Weight, g/mol:	409.1001
ΔH_f, kcal/mol:	-94.64
Dipole, Da:	6.31
IP(EA), eV:	-9.16(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[2-(2-bromo-4-methylphenoxy)propanoyl]piperidin-3-yl]imidazolidin-2-one

Drug info:

PubChemData

Smile

CC(C)C1=CC=C(C=C1)CCC(=O)N2CCCC(C2)N3CCNC3=O

DOS

IR

Vibrations