Geometry & MOs

Info

ID:	128573
PubChem CID:	51050848
Reduced:	NO3C10H15 (1)
Stoich.:	AB3C10D15 (1)
Weight, g/mol:	319.132077
ΔH_f, kcal/mol:	-140.84
Dipole, Da:	1.62
IP(EA), eV:	-10.05(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(4-cyanophenyl)diazenyl]-2,6-dimethylphenyl] 2-methylprop-2-enoate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CC=CCC1=O

DOS

IR

Vibrations