Geometry & MOs

Info

ID:	317472
PubChem CID:	126638405
Reduced:	N2O3H10C12 (1)
Stoich.:	A2B3C10D12 (1)
Weight, g/mol:	341.210327
ΔH_f, kcal/mol:	-68.15
Dipole, Da:	2.93
IP(EA), eV:	-9.15(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-2-methyl-N-piperidin-4-yl-3-(2,2,4-trimethylpyrano[2,3-c]pyridin-3-yl)prop-2-enamide

Drug info:

PubChemData

Smile

CC1C2=C(C3=C(O1)C=NC=C3)NC(=C2)C(=O)O

DOS

IR

Vibrations