Geometry & MOs

Info

ID:

388198

PubChem CID:

134988500

Reduced:

NOC7H11 (1)

Stoich.:

ABC7D11 (1)

Weight, g/mol:

240.136159

ΔHf, kcal/mol:

-25.21

Dipole, Da:

5.6

IP(EA), eV:

-9.58(-0.18)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC(=N/C(=C\C=O)/C)C

DOS

IR

Vibrations