Geometry & MOs

Info

ID:	387305
PubChem CID:	134984836
Reduced:	N2O4C23H30 (1)
Stoich.:	A2B4C23D30 (1)
Weight, g/mol:	322.168128
ΔH_f, kcal/mol:	-138.47
Dipole, Da:	6.58
IP(EA), eV:	-8.5(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-phenyl-2-[[(E)-1-phenylprop-1-en-2-yl]diazenyl]propan-2-yl] acetate

Drug info:

PubChemData

Smile

CC(=O)N=NC1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=C3C=CC(=C4)OC)C)OC(=O)C

DOS

IR

Vibrations