Geometry & MOs

Info

ID:	51347
PubChem CID:	12014001
Reduced:	OSN4H18C23 (1)
Stoich.:	ABC4D18E23 (1)
Weight, g/mol:	363.110673
ΔH_f, kcal/mol:	131.77
Dipole, Da:	7.95
IP(EA), eV:	-9.02(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

16,17-dimethoxy-13-methyl-3,5-dioxa-13-azapentacyclo[10.8.1.02,6.08,21.015,20]henicosa-1(21),2(6),7,9,11,15(20),16,18-octaen-14-one

Drug info:

PubChemData

Smile

C1C(=NN2C(=NN=C2S1)COC3=CC=CC=C3)C4=CC=C(C=C4)C5=CC=CC=C5

DOS

IR

Vibrations