Geometry & MOs

Info

ID:	38295
PubChem CID:	8029470
Reduced:	N3O3C19H23 (1)
Stoich.:	A3B3C19D23 (1)
Weight, g/mol:	309.147727
ΔH_f, kcal/mol:	-127.17
Dipole, Da:	3.01
IP(EA), eV:	-8.99(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-amino-3,3-dimethyl-7-(3-methylphenyl)-8-oxo-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile

Drug info:

PubChemData

Smile

C[C@H]1[C@@H]2[C@@H](C(=O)N(C2=O)C(C)(C)C)[C@@]3(N1)C4=CC=CC(=C4NC3=O)C

DOS

IR

Vibrations