Geometry & MOs

Info

ID:

339666

PubChem CID:

127261668

Reduced:

ON5C8H11 (1)

Stoich.:

AB5C8D11 (1)

Weight, g/mol:

216.101111

ΔHf, kcal/mol:

21.67

Dipole, Da:

4.11

IP(EA), eV:

-9.06(-0.58)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

[[(1Z)-1-indol-2-ylideneethyl]amino]urea

Drug info:

PubChemData

Smile

CC1=NC(=CC=C1)/N=C/NNC(=O)N

DOS

IR

Vibrations