Geometry & MOs

Info

ID:	307042
PubChem CID:	125264761
Reduced:	N3O3C14H21 (1)
Stoich.:	A3B3C14D21 (1)
Weight, g/mol:	279.158292
ΔH_f, kcal/mol:	-71.55
Dipole, Da:	3.66
IP(EA), eV:	-8.89(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3S,3aS,7aS)-3-(dimethylamino)-3,3a,5,6,7,7a-hexahydro-2H-pyrano[3,2-b]pyrrol-1-yl]-(5-methyl-1,2-oxazol-3-yl)methanone

Drug info:

PubChemData

Smile

CC1=CC(=NO1)C(=O)N2C[C@@H]([C@@H]3[C@H]2CCCO3)N(C)C

DOS

IR

Vibrations