Geometry & MOs

Info

ID:

226445

PubChem CID:

87352007

Reduced:

O7N9C57H67 (1)

Stoich.:

A7B9C57D67 (1)

Weight, g/mol:

625.90034

ΔHf, kcal/mol:

-174.16

Dipole, Da:

6.63

IP(EA), eV:

 -8.57(-1.01)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N,N-diiodocyclopropanamine;(1-methyl-3-prop-2-enylimidazol-2-ylidene)platinum

Drug info:

PubChemData

Smile

CC1(CCCN1C(=O)[C@@H](C2=CC=CC=C2)N(C)C)C(=O)N3CCC[C@H]3C(=O)NC4=CC=C(C=C4)C5=CN=C(O5)C6=CC=C(C=C6)NC(=O)[C@@H]7CCCN7C(=O)C8(CCCN8C(=O)[C@@H](C9=CC=CC=C9)N(C)C)C

DOS

IR

Vibrations