Geometry & MOs

Info

ID:

32329

PubChem CID:

6436537

Reduced:

OC14H24 (1)

Stoich.:

AB14C24 (1)

Weight, g/mol:

319.157229

ΔHf, kcal/mol:

-64.76

Dipole, Da:

3.76

IP(EA), eV:

-9.21(0.02)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(3Z)-3-(12H-[1]benzofuro[3,2-c][1]benzoxepin-6-ylidene)-N,N-dimethylpropan-1-amine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations