Geometry & MOs

Info

ID:	186524
PubChem CID:	77442731
Reduced:	SN4O7C32H48 (1)
Stoich.:	AB4C7D32E48 (1)
Weight, g/mol:	360.204907
ΔH_f, kcal/mol:	-276.7
Dipole, Da:	8.09
IP(EA), eV:	-9.23(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 4-(phenylmethoxycarbonylamino)-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrole-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NC1CCCCCC=CC2CC2(NCC3CC(CN3C1=O)(C4CC=CC=C4)O)C(=O)NS(=O)(=O)C5CC5

DOS

IR

Vibrations