Geometry & MOs

Info

ID:	392718
PubChem CID:	135017732
Reduced:	SiO4C34H46 (1)
Stoich.:	AB4C34D46 (1)
Weight, g/mol:	155.142248
ΔH_f, kcal/mol:	-238.49
Dipole, Da:	5.34
IP(EA), eV:	-8.82(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C([C@@H]2[C@H]3C[C@H]4[C@@H]5CCC6=C([C@H]5CC[C@@]4([C@H]3OC2=O)C)C=CC(=C6)O[Si](C)(C)C(C)(C)C)O

DOS

IR

Vibrations