Geometry & MOs

Info

ID:	62555
PubChem CID:	26719865
Reduced:	O2N3H17C22 (1)
Stoich.:	A2B3C17D22 (1)
Weight, g/mol:	375.104148
ΔH_f, kcal/mol:	-6.18
Dipole, Da:	5.98
IP(EA), eV:	-8.58(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-N-naphthalen-2-yl-2-oxo-6-thia-1,8-diazatricyclo[7.3.0.03,7]dodeca-3(7),4,8-triene-5-carboxamide

Drug info:

PubChemData

Smile

C1CC2=NC3=C(C=CC(=C3)C(=O)NC4=CC5=CC=CC=C5C=C4)C(=O)N2C1

DOS

IR

Vibrations