Geometry & MOs

Info

ID:	341087
PubChem CID:	127263522
Reduced:	O2N3C11H17 (1)
Stoich.:	A2B3C11D17 (1)
Weight, g/mol:	374.220557
ΔH_f, kcal/mol:	-73.23
Dipole, Da:	4.35
IP(EA), eV:	-9.2(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-O-tert-butyl 3a-O-ethyl 1-benzyl-3,4,6,6a-tetrahydro-2H-pyrrolo[2,3-c]pyrrole-3a,5-dicarboxylate

Drug info:

PubChemData

Smile

CC(C)(C)NC(=O)OC1CCN2C1=NC=C2

DOS

IR

Vibrations