Geometry & MOs

Info

ID:	308684
PubChem CID:	126522380
Reduced:	SN7H21C25 (1)
Stoich.:	AB7C21D25 (1)
Weight, g/mol:	440.183503
ΔH_f, kcal/mol:	222.96
Dipole, Da:	7.36
IP(EA), eV:	-8.71(-2.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(2-methoxyethoxy)-4-[4-(2-methylprop-2-enoyloxy)phenyl]phenoxy]ethyl 2-methylprop-2-enoate

Drug info:

PubChemData

Smile

CN(C)CC1=CC(=CN=C1)C2=NC=C3C(=C2)/C(=C\4/C=C5C(=CC=NC5=N4)C6=CSC=C6)/NN3

DOS

IR

Vibrations