Geometry & MOs

Info

ID:	173249
PubChem CID:	75611636
Reduced:	O3N8C32H40 (1)
Stoich.:	A3B8C32D40 (1)
Weight, g/mol:	634.01894
ΔH_f, kcal/mol:	-32.61
Dipole, Da:	6.78
IP(EA), eV:	-9.0(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[(3,5-diiodo-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]-2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]acetohydrazide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(=NNC(=O)C(C2C3CCCCC3C(=O)NN2)NC(=O)C4=CC=CC=C4)C56CN7CN(C5)CN(C6)C7

DOS

IR

Vibrations