Geometry & MOs

Info

ID:	164445
PubChem CID:	74401039
Reduced:	SO3N4C22H26 (1)
Stoich.:	AB3C4D22E26 (1)
Weight, g/mol:	481.210052
ΔH_f, kcal/mol:	-19.01
Dipole, Da:	3.6
IP(EA), eV:	-8.22(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(3,4-dimethoxyphenyl)-3-[3-(3,4-dimethoxyphenyl)prop-2-enoyl]-N,N-dimethyl-4-oxohex-5-enamide

Drug info:

PubChemData

Smile

CC1=NC(=C(S1)N)C2=CC=C(C=C2)OCCCCCOC3=CC=C(C=C3)C(=NO)N

DOS

IR

Vibrations