Geometry & MOs

Info

ID:

437609

PubChem CID:

135226656

Reduced:

NC10H17 (1)

Stoich.:

AB10C17 (1)

Weight, g/mol:

569.394105

ΔHf, kcal/mol:

-17.02

Dipole, Da:

1.59

IP(EA), eV:

-8.9(1.5)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(6Z)-6-[[[3-[2-[[2,2-dimethyl-3-[(2-nitroso-3-propan-2-yloxycyclohexa-1,3-dien-1-yl)methylideneamino]propyl]amino]ethylamino]-2,2-dimethylpropyl]amino]methylidene]-2-propan-2-yloxycyclohexa-2,4-dien-1-one

Drug info:

PubChemData

Smile

CC1=CCC2CCNCC2C1

DOS

IR

Vibrations