Geometry & MOs

Info

ID:	313553
PubChem CID:	126615871
Reduced:	NPO3C9H16 (1)
Stoich.:	ABC3D9E16 (1)
Weight, g/mol:	332.103827
ΔH_f, kcal/mol:	-138.9
Dipole, Da:	2.74
IP(EA), eV:	-8.78(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-methylpyrazin-2-yl)-2-oxo-1-phosphanyl-5,6,8,9-tetrahydrooxepino[4,5-b]pyridine-4-carboxamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(CCOCC1)NP

DOS

IR

Vibrations