Geometry & MOs

Info

ID:	436748
PubChem CID:	135210461
Reduced:	N3O3C14H17 (1)
Stoich.:	A3B3C14D17 (1)
Weight, g/mol:	334.189257
ΔH_f, kcal/mol:	-27.85
Dipole, Da:	4.97
IP(EA), eV:	-8.54(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methoxy-[2-(2-oxa-8-azaspiro[3.5]nonan-8-yl)-5,6,8,9-tetrahydrooxepino[4,5-b]pyridin-4-yl]methanol

Drug info:

PubChemData

Smile

C1CCN(C1)C2=NC3=C(CCOCC3)C(=C2)C(=O)N=O

DOS

IR

Vibrations