Geometry & MOs

Info

ID:	3971
PubChem CID:	10512
Reduced:	N2O3C22H24 (1)
Stoich.:	A2B3C22D24 (1)
Weight, g/mol:	364.178693
ΔH_f, kcal/mol:	-69.06
Dipole, Da:	2.82
IP(EA), eV:	-8.22(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

10-methoxy-4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinolin-14-one

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)N3C4C25CCN6C5CC7C4C(CC3=O)OCC=C7C6

DOS

IR

Vibrations