Geometry & MOs

Info

ID:	421741
PubChem CID:	135116523
Reduced:	N2O3C19H22 (1)
Stoich.:	A2B3C19D22 (1)
Weight, g/mol:	348.158626
ΔH_f, kcal/mol:	-92.84
Dipole, Da:	5.26
IP(EA), eV:	-8.92(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,3-dihydroindol-1-yl)-2-[methyl-[(3-pyridin-2-yl-1,2-oxazol-5-yl)methyl]amino]ethanone

Drug info:

PubChemData

Smile

CC1=CN=C(C=C1)N2CC[C@]([C@H](C2)O)(CC3=CC=CC=C3)C(=O)O

DOS

IR

Vibrations