Geometry & MOs

Info

ID:	79943
PubChem CID:	49831645
Reduced:	BrSN2O2C28H29 (1)
Stoich.:	ABC2D2E28F29 (1)
Weight, g/mol:	204.126263
ΔH_f, kcal/mol:	-49.18
Dipole, Da:	4.66
IP(EA), eV:	-8.31(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,5S)-5-benzyl-2,3-dimethylimidazolidin-4-one

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)NC(=C2C3N(C(=O)CS3)C45CC6CC(C4)CC(C6)C5)C7=CC=CC=C7Br

DOS

IR

Vibrations