Geometry & MOs

Info

ID:

435579

PubChem CID:

135191858

Reduced:

NOC6H7 (2)

Stoich.:

ABC6D7 (2)

Weight, g/mol:

155.131014

ΔHf, kcal/mol:

-50.15

Dipole, Da:

7.62

IP(EA), eV:

-9.58(-0.21)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(E)-3-methyl-2-nitrosooct-3-ene

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CN2C=C(N=C2)C(O)O

DOS

IR

Vibrations