Geometry & MOs

Info

ID:	361202
PubChem CID:	127302157
Reduced:	N3O3C19H25 (1)
Stoich.:	A3B3C19D25 (1)
Weight, g/mol:	365.173942
ΔH_f, kcal/mol:	-85.57
Dipole, Da:	7.24
IP(EA), eV:	-9.08(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-4-oxo-N-(2,6,6-trimethyl-5,7-dihydro-4H-1-benzofuran-4-yl)cinnoline-3-carboxamide

Drug info:

PubChemData

Smile

CC1CCCCC1OCCNC(=O)C2=NN(C3=CC=CC=C3C2=O)C

DOS

IR

Vibrations