Geometry & MOs

Info

ID:

322594

PubChem CID:

126670609

Reduced:

C4N5H9 (1)

Stoich.:

A4B5C9 (1)

Weight, g/mol:

191.1674

ΔHf, kcal/mol:

80.14

Dipole, Da:

5.52

IP(EA), eV:

-11.06(-0.33)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

N-[(E)-cyclohexa-2,4-dien-1-ylidenemethyl]-N-methylpentan-3-amine

Drug info:

PubChemData

Smile

CC(C)C1=NN=NN1N

DOS

IR

Vibrations