Geometry & MOs

Info

ID:	297993
PubChem CID:	117645042
Reduced:	ClO2N4C12H13 (1)
Stoich.:	AB2C4D12E13 (1)
Weight, g/mol:	519.192688
ΔH_f, kcal/mol:	-30.1
Dipole, Da:	2.97
IP(EA), eV:	-9.1(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(E)-3-[6-methoxy-2,4-bis(methoxymethoxy)-3-(3-methylbut-2-enyl)phenyl]-3-oxoprop-1-enyl]phenyl]methanesulfonamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(N(N=C1)CC2=NC=C(C=C2)Cl)N

DOS

IR

Vibrations