Geometry & MOs

Info

ID:

384020

PubChem CID:

134976183

Reduced:

NOC17H30 (1)

Stoich.:

ABC17D30 (1)

Weight, g/mol:

308.222569

ΔHf, kcal/mol:

24.11

Dipole, Da:

3.14

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 1.764228

Charge, e:

 0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCCCC1=C(C1C2CCC(N2[O])(C)C)CCCC

DOS

IR

Vibrations