Geometry & MOs

Info

ID:	89934
PubChem CID:	49965420
Reduced:	OS2N4H24C25 (1)
Stoich.:	AB2C4D24E25 (1)
Weight, g/mol:	508.13359
ΔH_f, kcal/mol:	48.16
Dipole, Da:	6.2
IP(EA), eV:	-8.51(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-6-benzyl-N-(4-chloro-2,5-dimethoxyphenyl)-7,8-dihydro-5H-thieno[2,3-b][1,6]naphthyridine-2-carboxamide

Drug info:

PubChemData

Smile

CSC1=CC=CC=C1NC(=O)C2=C(C3=C(S2)N=C4CCN(CC4=C3)CC5=CC=CC=C5)N

DOS

IR

Vibrations