Geometry & MOs

Info

ID:	18697
PubChem CID:	546455
Reduced:	NO3C10H13 (1)
Stoich.:	AB3C10D13 (1)
Weight, g/mol:	195.089543
ΔH_f, kcal/mol:	-123.27
Dipole, Da:	11.78
IP(EA), eV:	-9.22(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(tert-butyliminomethyl)-6-hydroxypyran-2-one

Drug info:

PubChemData

Smile

CC(C)(C)N=CC1=C(OC(=O)C=C1)O

DOS

IR

Vibrations