Geometry & MOs

Info

ID:	216736
PubChem CID:	85086698
Reduced:	OSN3H15C16 (1)
Stoich.:	ABC3D15E16 (1)
Weight, g/mol:	297.172879
ΔH_f, kcal/mol:	37.72
Dipole, Da:	4.68
IP(EA), eV:	-9.35(-1.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

15,16-dimethoxy-10-methyl-10-azatricyclo[11.4.0.03,8]heptadeca-1(17),2,4,6,13,15-hexaene

Drug info:

PubChemData

Smile

C1CC2C(CC1N2)NC(=O)C3=CC4=C(C=C3)C=C(S4)C#N

DOS

IR

Vibrations