Geometry & MOs

Info

ID:	391447
PubChem CID:	135005230
Reduced:	NOC18H19 (1)
Stoich.:	ABC18D19 (1)
Weight, g/mol:	243.162314
ΔH_f, kcal/mol:	25.29
Dipole, Da:	3.63
IP(EA), eV:	-8.97(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,4,6-trimethylphenyl)-2-oxa-3-azaspiro[4.4]non-3-ene

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)C)C2=NOCC2C3=CC=CC=C3)C

DOS

IR

Vibrations