Geometry & MOs

Info

ID:	306954
PubChem CID:	125264421
Reduced:	FN5C18H28 (1)
Stoich.:	AB5C18D28 (1)
Weight, g/mol:	305.173942
ΔH_f, kcal/mol:	10.69
Dipole, Da:	3.19
IP(EA), eV:	-8.52(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3aR,6aR)-5-(2,5-dimethylfuran-3-carbonyl)-N,1-dimethyl-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrole-2-carboxamide

Drug info:

PubChemData

Smile

CN(C)C[C@@H]1C[C@H]2CN(CC[C@H]2N1CC3CC3)C4=NC=C(C=N4)F

DOS

IR

Vibrations