Geometry & MOs

Info

ID:	242618
PubChem CID:	97857594
Reduced:	N3O3C16H19 (1)
Stoich.:	A3B3C16D19 (1)
Weight, g/mol:	301.142641
ΔH_f, kcal/mol:	-108.76
Dipole, Da:	7.08
IP(EA), eV:	-9.69(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-[(7aR)-1,3-dioxo-5,6,7,7a-tetrahydropyrrolo[1,2-c]imidazol-2-yl]ethyl]-N-methylbenzamide

Drug info:

PubChemData

Smile

CNC(=O)C1=CC=CC(=C1)CCN2C(=O)[C@@H]3CCCN3C2=O

DOS

IR

Vibrations