Geometry & MOs

Info

ID:	375827
PubChem CID:	134221818
Reduced:	N2O4C29H38 (1)
Stoich.:	A2B4C29D38 (1)
Weight, g/mol:	386.163043
ΔH_f, kcal/mol:	-188.53
Dipole, Da:	4.18
IP(EA), eV:	-8.53(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[6-methyl-4-(4-methylphenyl)-1-(pyridine-4-carbonyl)-2,3-dihydroindol-5-yl]acetic acid

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=C(C(=CC3=C2CCN3C(=O)NC4CCCCC4)C)[C@@H](C(=O)O)OC(C)(C)C

DOS

IR

Vibrations