Geometry & MOs

Info

ID:

44333

PubChem CID:

10502793

Reduced:

PN7O7C14H22 (1)

Stoich.:

AB7C7D14E22 (1)

Weight, g/mol:

431.158017

ΔHf, kcal/mol:

-306.47

Dipole, Da:

11.92

IP(EA), eV:

 -9.39(-0.27)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-(15-hydroxy-3,4,5,14-tetramethoxy-16-oxo-11-oxatricyclo[10.5.0.02,7]heptadeca-1(17),2,4,6,12,14-hexaen-10-yl)acetamide

Drug info:

PubChemData

Smile

CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)COP(=O)(N[C@@H](C)C(=O)NC)O)N=[N+]=[N-]

DOS

IR

Vibrations