Geometry & MOs

Info

ID:

176062

PubChem CID:

75989801

Reduced:

NO4C26H33 (1)

Stoich.:

AB4C26D33 (1)

Weight, g/mol:

782.359858

ΔHf, kcal/mol:

-146.51

Dipole, Da:

6.68

IP(EA), eV:

 -8.8(-0.96)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

6-[[tert-butyl(diphenyl)silyl]oxymethyl]-7,8,10-trimethoxy-9-methyl-3-[(2,4,5-trimethoxy-3-methylphenyl)methyl]-3,6,11,11a-tetrahydro-2H-pyrazino[1,2-b]isoquinoline-1,4-dione

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=CC(=C(N2C)C=CC(=O)OCC(C)C)C=CC(=O)OCC(C)C

DOS

IR

Vibrations