Geometry & MOs

Info

ID:

53140

PubChem CID:

14709644

Reduced:

NC18H19 (1)

Stoich.:

AB18C19 (1)

Weight, g/mol:

207.104799

ΔHf, kcal/mol:

54.39

Dipole, Da:

2.9

IP(EA), eV:

-8.91(-0.48)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

7-methyl-5-phenyl-5H-cyclopenta[b]pyridine

Drug info:

PubChemData

Smile

CCCCC1C=C(C2=C1C=CC=N2)C3=CC=CC=C3

DOS

IR

Vibrations