Geometry & MOs

Info

ID:

12459

PubChem CID:

138119

Reduced:

N3C7H7 (1)

Stoich.:

A3B7C7 (1)

Weight, g/mol:

133.063997

ΔHf, kcal/mol:

86.88

Dipole, Da:

3.0

IP(EA), eV:

-9.07(-0.45)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-azido-3-methylbenzene

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)N=[N+]=[N-]

DOS

IR

Vibrations