Geometry & MOs

Info

ID:	306997
PubChem CID:	125264598
Reduced:	ON2C9H13 (2)
Stoich.:	AB2C9D13 (2)
Weight, g/mol:	327.194677
ΔH_f, kcal/mol:	-30.73
Dipole, Da:	5.5
IP(EA), eV:	-9.07(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R,3aR,7aS)-1-(furan-2-ylmethyl)-N-methyl-N-(pyridin-3-ylmethyl)-3,3a,5,6,7,7a-hexahydro-2H-pyrano[3,2-b]pyrrol-3-amine

Drug info:

PubChemData

Smile

CN(CC1=CN=CC=C1)[C@@H]2CN([C@H]3[C@H]2OCCC3)C(=O)NC4CC4

DOS

IR

Vibrations