Geometry & MOs

Info

ID:

288200

PubChem CID:

104313456

Reduced:

BrN2C9H11 (1)

Stoich.:

AB2C9D11 (1)

Weight, g/mol:

240.02621

ΔHf, kcal/mol:

41.82

Dipole, Da:

3.4

IP(EA), eV:

-9.55(-0.66)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-(3-bromopyridin-2-yl)pent-4-en-1-amine

Drug info:

PubChemData

Smile

CC(=C)C(C1=C(C=CC=N1)Br)N

DOS

IR

Vibrations