Geometry & MOs

Info

ID:	253781
PubChem CID:	103120587
Reduced:	ON4C16H20 (1)
Stoich.:	AB4C16D20 (1)
Weight, g/mol:	234.148061
ΔH_f, kcal/mol:	13.13
Dipole, Da:	1.61
IP(EA), eV:	-9.09(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-methyl-3,3a,4,5,6,6a-hexahydro-2H-pyrrolo[2,3-c]pyrrol-1-yl)-(1-methylpyrazol-3-yl)methanone

Drug info:

PubChemData

Smile

C1CC2(C1)CC(CCN2)NC(=O)C3=C4C=CC=CN4N=C3

DOS

IR

Vibrations