Geometry & MOs

Info

ID:	48240
PubChem CID:	10538184
Reduced:	NO3H13C14 (1)
Stoich.:	AB3C13D14 (1)
Weight, g/mol:	243.181057
ΔH_f, kcal/mol:	-94.59
Dipole, Da:	3.26
IP(EA), eV:	-8.99(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

lithium;tert-butyl 4-butyl-2,4-dihydropyridin-2-ide-1-carboxylate

Drug info:

PubChemData

Smile

CC(=O)/C(=C\1/C=CC2=CC=CC=C2N1)/C(=O)OC

DOS

IR

Vibrations