Geometry & MOs

Info

ID:

374871

PubChem CID:

131349606

Reduced:

BrN2C12H13 (1)

Stoich.:

AB2C12D13 (1)

Weight, g/mol:

204.137497

ΔHf, kcal/mol:

54.9

Dipole, Da:

3.37

IP(EA), eV:

-8.93(0.11)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

[5-(2,5-dimethylpyrrol-1-yl)-1-methylimidazol-2-yl]methanamine

Drug info:

PubChemData

Smile

CC(C)N1C=C(C(=N1)C2=CC=CC=C2)Br

DOS

IR

Vibrations