Geometry & MOs

Info

ID:	51493
PubChem CID:	12014170
Reduced:	N2O3C17H20 (1)
Stoich.:	A2B3C17D20 (1)
Weight, g/mol:	428.05471
ΔH_f, kcal/mol:	-96.94
Dipole, Da:	4.14
IP(EA), eV:	-9.82(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6S,6aR)-3a-[bromo(difluoro)methyl]-2-ethyl-6-phenyl-5-propan-2-yl-6,6a-dihydropyrrolo[3,4-c]pyrrole-1,3,4-trione

Drug info:

PubChemData

Smile

CCN1C(=O)[C@H]2[C@H](N(C(=O)C2C1=O)C(C)C)C3=CC=CC=C3

DOS

IR

Vibrations