Geometry & MOs

Info

ID:	414371
PubChem CID:	135087327
Reduced:	SO2N3C17H19 (1)
Stoich.:	AB2C3D17E19 (1)
Weight, g/mol:	373.175004
ΔH_f, kcal/mol:	-30.87
Dipole, Da:	5.87
IP(EA), eV:	-9.02(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

19-methoxy-15-methyl-2-oxa-5,6,7,12,15-pentazatricyclo[15.2.2.15,8]docosa-1(19),6,8(22),17,20-pentaene-11,16-dione

Drug info:

PubChemData

Smile

C1COC2(CCN(CC2)C(=O)C3=NC(=CC=C3)N)C4=C1C=CS4

DOS

IR

Vibrations