Geometry & MOs

Info

ID:	430235
PubChem CID:	135170299
Reduced:	NC7H14 (2)
Stoich.:	AB7C14 (2)
Weight, g/mol:	178.146999
ΔH_f, kcal/mol:	-22.68
Dipole, Da:	2.84
IP(EA), eV:	-8.34(2.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3aS,6aR)-2,5-dimethyl-4-prop-1-ynyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole

Drug info:

PubChemData

Smile

CC[C@@]1([C@@H]2CCC([C@]1(C)CNC)N(C2)C)C

DOS

IR

Vibrations