Geometry & MOs

Info

ID:	128160
PubChem CID:	51033145
Reduced:	N2O3C17H20 (1)
Stoich.:	A2B3C17D20 (1)
Weight, g/mol:	314.163043
ΔH_f, kcal/mol:	-112.39
Dipole, Da:	1.9
IP(EA), eV:	-8.86(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,12S)-6-methoxy-12-methyl-10,17-diazatetracyclo[8.8.0.02,7.012,17]octadeca-2(7),3,5-triene-11,16-dione

Drug info:

PubChemData

Smile

C[C@@]12CCC(=O)N1C[C@@H]3C4=C(CCN3C2=O)C(=CC=C4)OC

DOS

IR

Vibrations