Geometry & MOs

Info

ID:	161919
PubChem CID:	57393065
Reduced:	SO3N5C21H23 (1)
Stoich.:	AB3C5D21E23 (1)
Weight, g/mol:	232.121178
ΔH_f, kcal/mol:	-37.32
Dipole, Da:	6.81
IP(EA), eV:	-8.63(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2R,5R)-5-phenyl-1,4-dioxan-2-yl]-4,5-dihydro-1H-imidazole

Drug info:

PubChemData

Smile

C1CN(CCN1C2=CC=NC=C2)C(=O)CCNS(=O)(=O)C3=CC=CC4=C3C=CC=N4

DOS

IR

Vibrations