Geometry & MOs

Info

ID:	369115
PubChem CID:	127331299
Reduced:	N3O4C15H19 (1)
Stoich.:	A3B4C15D19 (1)
Weight, g/mol:	327.158292
ΔH_f, kcal/mol:	-118.78
Dipole, Da:	5.45
IP(EA), eV:	-9.12(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5,6-dimethylfuro[2,3-d]pyrimidin-4-yl)-9-oxobicyclo[3.3.1]nonane-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(OC2=NC=NC(=C12)NC(=O)COC3CCOCC3)C

DOS

IR

Vibrations