Geometry & MOs

Info

ID:

214681

PubChem CID:

85083391

Reduced:

PN3O7C29H40 (1)

Stoich.:

AB3C7D29E40 (1)

Weight, g/mol:

573.2475

ΔHf, kcal/mol:

-394.38

Dipole, Da:

7.45

IP(EA), eV:

 -8.18(0.12)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

4-(dimethylamino)-10,12a-dihydroxy-1,3,11,12-tetraoxo-7-[4-(pyrrolidin-1-ylmethyl)phenyl]-4,4a,5,5a,6,11a-hexahydrotetracene-2-carboxamide

Drug info:

PubChemData

Smile

CC(CC1=CNC2=CC=CC=C21)(C(=O)NC3CCCCC3OP(=O)(O)O)NC(=O)OC4C5CC6CC(C5)CC4C6

DOS

IR

Vibrations