Geometry & MOs

Info

ID:	148970
PubChem CID:	53788641
Reduced:	SN3O5C15H19 (1)
Stoich.:	AB3C5D15E19 (1)
Weight, g/mol:	383.163377
ΔH_f, kcal/mol:	-188.78
Dipole, Da:	5.1
IP(EA), eV:	-9.41(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-benzyl-8-methyl-3-[(pyridin-4-ylmethylamino)methylidene]quinoline-2,4-dione

Drug info:

PubChemData

Smile

CC1=CC(=NN1)C(=O)C(CC(=O)N2CCC[C@H]2C(=O)O)SC(=O)C

DOS

IR

Vibrations