Geometry & MOs

Info

ID:	397553
PubChem CID:	135030377
Reduced:	FNO7C28H34 (1)
Stoich.:	ABC7D28E34 (1)
Weight, g/mol:	471.144865
ΔH_f, kcal/mol:	-330.41
Dipole, Da:	3.35
IP(EA), eV:	-8.36(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[2-chloro-5-[3-(2-ethoxy-2-oxoethyl)-5-methoxy-2-methylindole-1-carbonyl]phenyl]acetate

Drug info:

PubChemData

Smile

CCOC(=O)CC1=C(C=CC(=C1)[C@@H]2CCN(C[C@H]2COC3=CC4=C(C=C3)OCO4)C(=O)OC(C)(C)C)F

DOS

IR

Vibrations