Geometry & MOs

Info

ID:	439549
PubChem CID:	135229325
Reduced:	FN3C27H40 (1)
Stoich.:	AB3C27D40 (1)
Weight, g/mol:	378.137971
ΔH_f, kcal/mol:	-52.74
Dipole, Da:	1.77
IP(EA), eV:	-8.3(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-fluoro-1-methylindol-3-yl)-4-(3-propoxyphenyl)pyrrole-2,5-dione

Drug info:

PubChemData

Smile

CCCCCCC(CCCCC)C1(CCN(CC1)C2=CC=C(C=C2)C3=NC=CC=N3)F

DOS

IR

Vibrations