Geometry & MOs

Info

ID:	415769
PubChem CID:	135088769
Reduced:	NO2C11H13 (2)
Stoich.:	AB2C11D13 (2)
Weight, g/mol:	289.142641
ΔH_f, kcal/mol:	-96.23
Dipole, Da:	4.68
IP(EA), eV:	-8.98(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-methyl-1-oxa-9-azaspiro[5.5]undec-4-ene-9-carbonyl)-1H-pyrazin-2-one

Drug info:

PubChemData

Smile

CC1=CC(=C2C(=C1)OC=C2CC(=O)N3C[C@H]([C@H](C3)OC)CC4=CC(=NO4)C)C

DOS

IR

Vibrations