Geometry & MOs

Info

ID:	149511
PubChem CID:	53789184
Reduced:	SN3O3H21C22 (1)
Stoich.:	AB3C3D21E22 (1)
Weight, g/mol:	409.188923
ΔH_f, kcal/mol:	-22.94
Dipole, Da:	8.62
IP(EA), eV:	-8.88(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[1-(4-nitrophenyl)-2-phenylethenoxy]hexyl 2-methylprop-2-enoate

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)C2=C(C(=CC(=C2)C3=C4C=CC=CN4N=C3)C)S(=O)(=O)N

DOS

IR

Vibrations