Geometry & MOs

Info

ID:	375865
PubChem CID:	134221859
Reduced:	NO4C29H29 (1)
Stoich.:	AB4C29D29 (1)
Weight, g/mol:	486.215472
ΔH_f, kcal/mol:	-137.04
Dipole, Da:	9.1
IP(EA), eV:	-8.73(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(8-methoxy-5-methyl-3,4-dihydro-2H-chromen-6-yl)-6-methyl-1-(6-methylpyridine-3-carbonyl)-2,3-dihydroindol-5-yl]acetic acid

Drug info:

PubChemData

Smile

CC1=CC=CC=C1C(=O)N2CCC3=C2C=C(C(=C3C4=C(C5=C(C=C4)OCCC5)C)CC(=O)O)C

DOS

IR

Vibrations