Geometry & MOs

Info

ID:	228418
PubChem CID:	87564316
Reduced:	SN3O3C17H17 (1)
Stoich.:	AB3C3D17E17 (1)
Weight, g/mol:	464.03856
ΔH_f, kcal/mol:	-74.11
Dipole, Da:	4.74
IP(EA), eV:	-9.05(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2-iodophenyl)-diphenylmethyl]imidazole-4-carbaldehyde

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)C(=O)NC(=O)N(C2=CC=C(C=C2)C(=O)N)S

DOS

IR

Vibrations