Geometry & MOs

Info

ID:

382790

PubChem CID:

134974140

Reduced:

O6C15H31 (2)

Stoich.:

A6B15C31 (2)

Weight, g/mol:

278.178299

ΔHf, kcal/mol:

-684.0

Dipole, Da:

5.44

IP(EA), eV:

 -9.61(2.16)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-methyl-N-[(E)-5-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,10(14),11,15-hexaenylmethylideneamino]methanamine

Drug info:

PubChemData

Smile

C[C@@](CC[C@H]([C@@](C)(CC[C@H](C(C)(C)O)O)O)O)([C@@H](CC[C@H]([C@@](C)(CC[C@H]([C@@](C)(CC[C@H](C(C)(C)O)O)O)O)O)O)O)O

DOS

IR

Vibrations