Geometry & MOs

Info

ID:

327888

PubChem CID:

126691241

Reduced:

ON2H44C56 (1)

Stoich.:

AB2C44D56 (1)

Weight, g/mol:

292.193949

ΔHf, kcal/mol:

168.02

Dipole, Da:

2.84

IP(EA), eV:

 -7.74(-0.41)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenyl)piperidin-3-amine

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N2C3=C(C=C(C=C3)C4=CC=C(C=C4)N(C5=CC=C(C=C5)C6=CC(=CC=C6)C(=C)C)C7=CC=C(C=C7)C8=CC=CC9=C8OC(=C9C)C)C1=CC=CC=C12

DOS

IR

Vibrations