Geometry & MOs

Info

ID:	306748
PubChem CID:	125237162
Reduced:	N2O3C17H24 (1)
Stoich.:	A2B3C17D24 (1)
Weight, g/mol:	334.171499
ΔH_f, kcal/mol:	-90.89
Dipole, Da:	4.59
IP(EA), eV:	-8.96(0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S,4aR,8aS)-N-cyclopropyl-6-[(5-methylthiophen-2-yl)methyl]-2,3,4,4a,5,7,8,8a-octahydropyrano[3,2-c]pyridine-4-carboxamide

Drug info:

PubChemData

Smile

C1CN(C[C@H]2[C@H]1OCC[C@H]2C(=O)NC3CC3)CC4=CC=CO4

DOS

IR

Vibrations