Geometry & MOs

Info

ID:	306747
PubChem CID:	125237126
Reduced:	NOC8H13 (2)
Stoich.:	ABC8D13 (2)
Weight, g/mol:	304.178693
ΔH_f, kcal/mol:	-64.6
Dipole, Da:	3.78
IP(EA), eV:	-9.06(1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R,4aS,8aS)-N-cyclopropyl-6-(furan-2-ylmethyl)-2,3,4,4a,5,7,8,8a-octahydropyrano[3,2-c]pyridine-4-carboxamide

Drug info:

PubChemData

Smile

C1CC(C1)NC(=O)C[C@@H]2C[C@@H]3CN(C[C@H]3O2)CC4CC4

DOS

IR

Vibrations