Geometry & MOs

Info

ID:	231479
PubChem CID:	87573845
Reduced:	SO3N5C9H9 (1)
Stoich.:	AB3C5D9E9 (1)
Weight, g/mol:	426.186277
ΔH_f, kcal/mol:	-25.61
Dipole, Da:	5.81
IP(EA), eV:	-9.8(-1.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(1-tert-butylcyclobutyl)phenyl]-6-chloro-3-phenyl-1,5-naphthyridine

Drug info:

PubChemData

Smile

CC(=O)C1=CN=C(S1)CN2N=CC(=N2)NC(=O)O

DOS

IR

Vibrations